USER MOD reduce.3.24.130724 H: found=0, std=0, add=808, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 807 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 8 SER OG : rot 75:sc= 0.835 USER MOD Set 1.2: A 18 SER OG : rot 60:sc= 0.49 USER MOD Set 2.1: A 1 MET CE :methyl -169:sc= 0 (180deg=-0.184) USER MOD Set 2.2: A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 MET N :NH3+ -156:sc= 0.339 (180deg=0.0718) USER MOD Single : A 10 ASN : amide:sc= -0.406 K(o=-0.41,f=-3.3!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 180:sc= -0.105 USER MOD Single : A 20 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 ASN : amide:sc=-0.000868 X(o=-0.00087,f=-0.00087) USER MOD Single : A 35 ASN : amide:sc= 0.428 X(o=0.43,f=0) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= 0.881 K(o=0.88,f=-8.3!) USER MOD Single : A 58 ASN : amide:sc= -0.135 K(o=-0.13,f=-1.6!) USER MOD Single : A 61 LYS NZ :NH3+ -143:sc= -0.117 (180deg=-1.15) USER MOD Single : A 63 LYS NZ :NH3+ 136:sc= 1.28 (180deg=0.56) USER MOD Single : A 84 MET CE :methyl 180:sc= -0.643 (180deg=-0.643) USER MOD Single : A 87 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.062) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -4.006 -9.246 -4.552 1.00 0.00 N ATOM 2 CA MET A 1 -3.876 -7.861 -4.092 1.00 0.00 C ATOM 3 C MET A 1 -2.649 -7.661 -3.231 1.00 0.00 C ATOM 4 O MET A 1 -2.272 -8.529 -2.442 1.00 0.00 O ATOM 5 CB MET A 1 -5.189 -7.326 -3.497 1.00 0.00 C ATOM 6 CG MET A 1 -5.391 -7.354 -1.994 1.00 0.00 C ATOM 7 SD MET A 1 -7.144 -7.579 -1.534 1.00 0.00 S ATOM 8 CE MET A 1 -7.972 -6.313 -2.560 1.00 0.00 C ATOM 0 H1 MET A 1 -4.575 -9.271 -5.422 1.00 0.00 H new ATOM 0 H2 MET A 1 -3.062 -9.638 -4.744 1.00 0.00 H new ATOM 0 H3 MET A 1 -4.473 -9.814 -3.817 1.00 0.00 H new ATOM 0 HA MET A 1 -3.698 -7.230 -4.963 1.00 0.00 H new ATOM 0 HB2 MET A 1 -5.298 -6.291 -3.823 1.00 0.00 H new ATOM 0 HB3 MET A 1 -6.006 -7.890 -3.947 1.00 0.00 H new ATOM 0 HG2 MET A 1 -4.799 -8.162 -1.565 1.00 0.00 H new ATOM 0 HG3 MET A 1 -5.021 -6.424 -1.563 1.00 0.00 H new ATOM 0 HE1 MET A 1 -9.008 -6.206 -2.240 1.00 0.00 H new ATOM 0 HE2 MET A 1 -7.457 -5.359 -2.447 1.00 0.00 H new ATOM 0 HE3 MET A 1 -7.945 -6.618 -3.606 1.00 0.00 H new ATOM 18 N ILE A 2 -2.033 -6.495 -3.397 1.00 0.00 N ATOM 19 CA ILE A 2 -0.887 -5.995 -2.653 1.00 0.00 C ATOM 20 C ILE A 2 -1.330 -4.590 -2.239 1.00 0.00 C ATOM 21 O ILE A 2 -2.029 -3.908 -3.001 1.00 0.00 O ATOM 22 CB ILE A 2 0.388 -5.974 -3.528 1.00 0.00 C ATOM 23 CG1 ILE A 2 0.486 -7.243 -4.398 1.00 0.00 C ATOM 24 CG2 ILE A 2 1.662 -5.752 -2.711 1.00 0.00 C ATOM 25 CD1 ILE A 2 1.796 -7.446 -5.159 1.00 0.00 C ATOM 0 H ILE A 2 -2.345 -5.830 -4.105 1.00 0.00 H new ATOM 0 HA ILE A 2 -0.619 -6.618 -1.799 1.00 0.00 H new ATOM 0 HB ILE A 2 0.299 -5.115 -4.193 1.00 0.00 H new ATOM 0 HG12 ILE A 2 0.325 -8.110 -3.757 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -0.330 -7.226 -5.121 1.00 0.00 H new ATOM 0 HG21 ILE A 2 2.525 -5.747 -3.377 1.00 0.00 H new ATOM 0 HG22 ILE A 2 1.599 -4.796 -2.191 1.00 0.00 H new ATOM 0 HG23 ILE A 2 1.771 -6.555 -1.982 1.00 0.00 H new ATOM 0 HD11 ILE A 2 1.744 -8.371 -5.733 1.00 0.00 H new ATOM 0 HD12 ILE A 2 1.957 -6.607 -5.836 1.00 0.00 H new ATOM 0 HD13 ILE A 2 2.623 -7.505 -4.451 1.00 0.00 H new ATOM 37 N ILE A 3 -0.974 -4.207 -1.024 1.00 0.00 N ATOM 38 CA ILE A 3 -1.517 -3.133 -0.215 1.00 0.00 C ATOM 39 C ILE A 3 -0.343 -2.248 0.166 1.00 0.00 C ATOM 40 O ILE A 3 0.419 -2.627 1.048 1.00 0.00 O ATOM 41 CB ILE A 3 -2.174 -3.765 1.032 1.00 0.00 C ATOM 42 CG1 ILE A 3 -3.484 -4.467 0.665 1.00 0.00 C ATOM 43 CG2 ILE A 3 -2.381 -2.736 2.150 1.00 0.00 C ATOM 44 CD1 ILE A 3 -3.832 -5.549 1.694 1.00 0.00 C ATOM 0 H ILE A 3 -0.222 -4.690 -0.533 1.00 0.00 H new ATOM 0 HA ILE A 3 -2.270 -2.542 -0.736 1.00 0.00 H new ATOM 0 HB ILE A 3 -1.488 -4.519 1.418 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -4.291 -3.736 0.613 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -3.396 -4.915 -0.325 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -2.845 -3.220 3.009 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -1.417 -2.320 2.445 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -3.028 -1.935 1.792 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -4.767 -6.033 1.411 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -3.034 -6.291 1.726 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -3.943 -5.093 2.678 1.00 0.00 H new ATOM 56 N ALA A 4 -0.145 -1.120 -0.507 1.00 0.00 N ATOM 57 CA ALA A 4 0.926 -0.209 -0.077 1.00 0.00 C ATOM 58 C ALA A 4 0.424 0.685 1.042 1.00 0.00 C ATOM 59 O ALA A 4 -0.714 1.161 1.000 1.00 0.00 O ATOM 60 CB ALA A 4 1.532 0.642 -1.199 1.00 0.00 C ATOM 0 H ALA A 4 -0.682 -0.817 -1.319 1.00 0.00 H new ATOM 0 HA ALA A 4 1.736 -0.849 0.273 1.00 0.00 H new ATOM 0 HB1 ALA A 4 2.313 1.282 -0.789 1.00 0.00 H new ATOM 0 HB2 ALA A 4 1.960 -0.011 -1.960 1.00 0.00 H new ATOM 0 HB3 ALA A 4 0.754 1.260 -1.647 1.00 0.00 H new ATOM 66 N ILE A 5 1.321 1.009 1.966 1.00 0.00 N ATOM 67 CA ILE A 5 1.149 2.052 2.961 1.00 0.00 C ATOM 68 C ILE A 5 2.435 2.881 2.905 1.00 0.00 C ATOM 69 O ILE A 5 3.521 2.300 2.967 1.00 0.00 O ATOM 70 CB ILE A 5 0.860 1.444 4.349 1.00 0.00 C ATOM 71 CG1 ILE A 5 -0.506 0.725 4.328 1.00 0.00 C ATOM 72 CG2 ILE A 5 0.823 2.554 5.413 1.00 0.00 C ATOM 73 CD1 ILE A 5 -0.782 -0.170 5.532 1.00 0.00 C ATOM 0 H ILE A 5 2.220 0.533 2.043 1.00 0.00 H new ATOM 0 HA ILE A 5 0.288 2.690 2.762 1.00 0.00 H new ATOM 0 HB ILE A 5 1.650 0.733 4.591 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -1.294 1.476 4.264 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -0.568 0.120 3.423 1.00 0.00 H new ATOM 0 HG21 ILE A 5 0.618 2.115 6.390 1.00 0.00 H new ATOM 0 HG22 ILE A 5 1.785 3.065 5.439 1.00 0.00 H new ATOM 0 HG23 ILE A 5 0.039 3.270 5.165 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -1.764 -0.630 5.426 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -0.021 -0.948 5.589 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -0.758 0.428 6.443 1.00 0.00 H new ATOM 85 N PRO A 6 2.356 4.211 2.735 1.00 0.00 N ATOM 86 CA PRO A 6 3.528 5.059 2.742 1.00 0.00 C ATOM 87 C PRO A 6 3.954 5.185 4.198 1.00 0.00 C ATOM 88 O PRO A 6 3.218 5.805 4.970 1.00 0.00 O ATOM 89 CB PRO A 6 3.064 6.385 2.132 1.00 0.00 C ATOM 90 CG PRO A 6 1.561 6.459 2.393 1.00 0.00 C ATOM 91 CD PRO A 6 1.143 5.014 2.673 1.00 0.00 C ATOM 0 HA PRO A 6 4.382 4.688 2.175 1.00 0.00 H new ATOM 0 HB2 PRO A 6 3.582 7.228 2.589 1.00 0.00 H new ATOM 0 HB3 PRO A 6 3.278 6.420 1.064 1.00 0.00 H new ATOM 0 HG2 PRO A 6 1.338 7.107 3.241 1.00 0.00 H new ATOM 0 HG3 PRO A 6 1.029 6.865 1.533 1.00 0.00 H new ATOM 0 HD2 PRO A 6 0.592 4.949 3.611 1.00 0.00 H new ATOM 0 HD3 PRO A 6 0.481 4.648 1.889 1.00 0.00 H new ATOM 99 N VAL A 7 5.079 4.596 4.604 1.00 0.00 N ATOM 100 CA VAL A 7 5.517 4.650 5.996 1.00 0.00 C ATOM 101 C VAL A 7 6.749 5.525 6.145 1.00 0.00 C ATOM 102 O VAL A 7 7.435 5.873 5.180 1.00 0.00 O ATOM 103 CB VAL A 7 5.704 3.251 6.627 1.00 0.00 C ATOM 104 CG1 VAL A 7 4.388 2.488 6.740 1.00 0.00 C ATOM 105 CG2 VAL A 7 6.755 2.384 5.926 1.00 0.00 C ATOM 0 H VAL A 7 5.703 4.076 3.987 1.00 0.00 H new ATOM 0 HA VAL A 7 4.712 5.115 6.565 1.00 0.00 H new ATOM 0 HB VAL A 7 6.081 3.455 7.629 1.00 0.00 H new ATOM 0 HG11 VAL A 7 4.571 1.512 7.189 1.00 0.00 H new ATOM 0 HG12 VAL A 7 3.694 3.050 7.365 1.00 0.00 H new ATOM 0 HG13 VAL A 7 3.958 2.356 5.747 1.00 0.00 H new ATOM 0 HG21 VAL A 7 6.826 1.420 6.429 1.00 0.00 H new ATOM 0 HG22 VAL A 7 6.465 2.231 4.886 1.00 0.00 H new ATOM 0 HG23 VAL A 7 7.723 2.884 5.963 1.00 0.00 H new ATOM 115 N SER A 8 6.978 5.931 7.388 1.00 0.00 N ATOM 116 CA SER A 8 7.977 6.914 7.738 1.00 0.00 C ATOM 117 C SER A 8 9.307 6.264 8.113 1.00 0.00 C ATOM 118 O SER A 8 10.319 6.954 8.036 1.00 0.00 O ATOM 119 CB SER A 8 7.456 7.770 8.897 1.00 0.00 C ATOM 120 OG SER A 8 6.097 8.146 8.704 1.00 0.00 O ATOM 0 H SER A 8 6.460 5.575 8.191 1.00 0.00 H new ATOM 0 HA SER A 8 8.161 7.542 6.866 1.00 0.00 H new ATOM 0 HB2 SER A 8 7.551 7.215 9.831 1.00 0.00 H new ATOM 0 HB3 SER A 8 8.071 8.665 8.994 1.00 0.00 H new ATOM 0 HG SER A 8 5.517 7.374 8.873 1.00 0.00 H new ATOM 126 N GLU A 9 9.328 4.991 8.535 1.00 0.00 N ATOM 127 CA GLU A 9 10.526 4.320 9.036 1.00 0.00 C ATOM 128 C GLU A 9 10.433 2.824 8.699 1.00 0.00 C ATOM 129 O GLU A 9 9.354 2.334 8.341 1.00 0.00 O ATOM 130 CB GLU A 9 10.645 4.551 10.553 1.00 0.00 C ATOM 131 CG GLU A 9 10.972 6.005 10.911 1.00 0.00 C ATOM 132 CD GLU A 9 11.213 6.197 12.406 1.00 0.00 C ATOM 133 OE1 GLU A 9 12.166 5.597 12.949 1.00 0.00 O ATOM 134 OE2 GLU A 9 10.433 6.929 13.060 1.00 0.00 O ATOM 0 H GLU A 9 8.500 4.395 8.536 1.00 0.00 H new ATOM 0 HA GLU A 9 11.421 4.726 8.564 1.00 0.00 H new ATOM 0 HB2 GLU A 9 9.709 4.265 11.033 1.00 0.00 H new ATOM 0 HB3 GLU A 9 11.421 3.900 10.955 1.00 0.00 H new ATOM 0 HG2 GLU A 9 11.857 6.322 10.360 1.00 0.00 H new ATOM 0 HG3 GLU A 9 10.151 6.648 10.593 1.00 0.00 H new ATOM 141 N ASN A 10 11.543 2.086 8.796 1.00 0.00 N ATOM 142 CA ASN A 10 11.597 0.638 8.553 1.00 0.00 C ATOM 143 C ASN A 10 11.394 -0.101 9.859 1.00 0.00 C ATOM 144 O ASN A 10 12.324 -0.621 10.468 1.00 0.00 O ATOM 145 CB ASN A 10 12.880 0.193 7.837 1.00 0.00 C ATOM 146 CG ASN A 10 12.846 -1.297 7.472 1.00 0.00 C ATOM 147 OD1 ASN A 10 11.987 -2.065 7.901 1.00 0.00 O ATOM 148 ND2 ASN A 10 13.777 -1.757 6.653 1.00 0.00 N ATOM 0 H ASN A 10 12.447 2.484 9.050 1.00 0.00 H new ATOM 0 HA ASN A 10 10.787 0.385 7.869 1.00 0.00 H new ATOM 0 HB2 ASN A 10 13.014 0.785 6.932 1.00 0.00 H new ATOM 0 HB3 ASN A 10 13.740 0.390 8.477 1.00 0.00 H new ATOM 0 HD21 ASN A 10 13.778 -2.741 6.383 1.00 0.00 H new ATOM 0 HD22 ASN A 10 14.494 -1.128 6.291 1.00 0.00 H new ATOM 155 N ARG A 11 10.137 -0.155 10.282 1.00 0.00 N ATOM 156 CA ARG A 11 9.756 -0.729 11.558 1.00 0.00 C ATOM 157 C ARG A 11 8.730 -1.818 11.316 1.00 0.00 C ATOM 158 O ARG A 11 7.596 -1.650 11.740 1.00 0.00 O ATOM 159 CB ARG A 11 9.240 0.371 12.498 1.00 0.00 C ATOM 160 CG ARG A 11 10.220 1.526 12.707 1.00 0.00 C ATOM 161 CD ARG A 11 9.742 2.378 13.881 1.00 0.00 C ATOM 162 NE ARG A 11 10.700 3.433 14.247 1.00 0.00 N ATOM 163 CZ ARG A 11 10.714 4.070 15.421 1.00 0.00 C ATOM 164 NH1 ARG A 11 10.024 3.608 16.459 1.00 0.00 N ATOM 165 NH2 ARG A 11 11.391 5.198 15.540 1.00 0.00 N ATOM 0 H ARG A 11 9.350 0.203 9.741 1.00 0.00 H new ATOM 0 HA ARG A 11 10.618 -1.181 12.049 1.00 0.00 H new ATOM 0 HB2 ARG A 11 8.308 0.768 12.097 1.00 0.00 H new ATOM 0 HB3 ARG A 11 9.007 -0.073 13.466 1.00 0.00 H new ATOM 0 HG2 ARG A 11 11.220 1.140 12.905 1.00 0.00 H new ATOM 0 HG3 ARG A 11 10.285 2.133 11.804 1.00 0.00 H new ATOM 0 HD2 ARG A 11 8.785 2.834 13.627 1.00 0.00 H new ATOM 0 HD3 ARG A 11 9.569 1.735 14.744 1.00 0.00 H new ATOM 0 HE ARG A 11 11.403 3.696 13.556 1.00 0.00 H new ATOM 0 HH11 ARG A 11 9.473 2.755 16.366 1.00 0.00 H new ATOM 0 HH12 ARG A 11 10.046 4.107 17.348 1.00 0.00 H new ATOM 0 HH21 ARG A 11 11.897 5.576 14.739 1.00 0.00 H new ATOM 0 HH22 ARG A 11 11.407 5.691 16.433 1.00 0.00 H new ATOM 179 N GLY A 12 9.032 -2.845 10.519 1.00 0.00 N ATOM 180 CA GLY A 12 8.143 -3.964 10.175 1.00 0.00 C ATOM 181 C GLY A 12 7.064 -4.205 11.231 1.00 0.00 C ATOM 182 O GLY A 12 7.377 -4.495 12.387 1.00 0.00 O ATOM 0 H GLY A 12 9.946 -2.926 10.073 1.00 0.00 H new ATOM 0 HA2 GLY A 12 7.668 -3.763 9.215 1.00 0.00 H new ATOM 0 HA3 GLY A 12 8.736 -4.870 10.054 1.00 0.00 H new ATOM 186 N LYS A 13 5.793 -4.089 10.825 1.00 0.00 N ATOM 187 CA LYS A 13 4.547 -4.150 11.604 1.00 0.00 C ATOM 188 C LYS A 13 4.277 -2.827 12.299 1.00 0.00 C ATOM 189 O LYS A 13 3.263 -2.198 11.998 1.00 0.00 O ATOM 190 CB LYS A 13 4.518 -5.349 12.582 1.00 0.00 C ATOM 191 CG LYS A 13 4.846 -6.680 11.862 1.00 0.00 C ATOM 192 CD LYS A 13 5.211 -7.820 12.807 1.00 0.00 C ATOM 193 CE LYS A 13 6.590 -7.536 13.418 1.00 0.00 C ATOM 194 NZ LYS A 13 6.682 -7.951 14.827 1.00 0.00 N ATOM 0 H LYS A 13 5.590 -3.934 9.838 1.00 0.00 H new ATOM 0 HA LYS A 13 3.731 -4.323 10.902 1.00 0.00 H new ATOM 0 HB2 LYS A 13 5.237 -5.182 13.384 1.00 0.00 H new ATOM 0 HB3 LYS A 13 3.534 -5.418 13.045 1.00 0.00 H new ATOM 0 HG2 LYS A 13 3.986 -6.979 11.263 1.00 0.00 H new ATOM 0 HG3 LYS A 13 5.673 -6.514 11.172 1.00 0.00 H new ATOM 0 HD2 LYS A 13 4.462 -7.912 13.593 1.00 0.00 H new ATOM 0 HD3 LYS A 13 5.225 -8.767 12.268 1.00 0.00 H new ATOM 0 HE2 LYS A 13 7.354 -8.056 12.839 1.00 0.00 H new ATOM 0 HE3 LYS A 13 6.804 -6.470 13.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 7.633 -7.737 15.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 5.973 -7.436 15.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 6.506 -8.973 14.900 1.00 0.00 H new ATOM 208 N ASP A 14 5.207 -2.361 13.140 1.00 0.00 N ATOM 209 CA ASP A 14 5.129 -1.068 13.841 1.00 0.00 C ATOM 210 C ASP A 14 5.181 0.140 12.888 1.00 0.00 C ATOM 211 O ASP A 14 5.072 1.274 13.342 1.00 0.00 O ATOM 212 CB ASP A 14 6.277 -0.883 14.858 1.00 0.00 C ATOM 213 CG ASP A 14 6.623 -2.058 15.764 1.00 0.00 C ATOM 214 OD1 ASP A 14 6.062 -2.162 16.880 1.00 0.00 O ATOM 215 OD2 ASP A 14 7.548 -2.819 15.408 1.00 0.00 O ATOM 0 H ASP A 14 6.056 -2.882 13.359 1.00 0.00 H new ATOM 0 HA ASP A 14 4.165 -1.099 14.348 1.00 0.00 H new ATOM 0 HB2 ASP A 14 7.175 -0.613 14.303 1.00 0.00 H new ATOM 0 HB3 ASP A 14 6.027 -0.033 15.493 1.00 0.00 H new ATOM 220 N SER A 15 5.414 -0.094 11.595 1.00 0.00 N ATOM 221 CA SER A 15 5.751 0.829 10.513 1.00 0.00 C ATOM 222 C SER A 15 4.800 2.041 10.526 1.00 0.00 C ATOM 223 O SER A 15 3.636 1.890 10.145 1.00 0.00 O ATOM 224 CB SER A 15 5.703 0.023 9.220 1.00 0.00 C ATOM 225 OG SER A 15 6.550 -1.106 9.314 1.00 0.00 O ATOM 0 H SER A 15 5.365 -1.049 11.241 1.00 0.00 H new ATOM 0 HA SER A 15 6.749 1.253 10.626 1.00 0.00 H new ATOM 0 HB2 SER A 15 4.680 -0.297 9.020 1.00 0.00 H new ATOM 0 HB3 SER A 15 6.011 0.648 8.382 1.00 0.00 H new ATOM 0 HG SER A 15 6.509 -1.616 8.478 1.00 0.00 H new ATOM 231 N PRO A 16 5.227 3.217 11.020 1.00 0.00 N ATOM 232 CA PRO A 16 4.320 4.342 11.249 1.00 0.00 C ATOM 233 C PRO A 16 3.963 5.027 9.926 1.00 0.00 C ATOM 234 O PRO A 16 4.869 5.447 9.192 1.00 0.00 O ATOM 235 CB PRO A 16 5.070 5.272 12.205 1.00 0.00 C ATOM 236 CG PRO A 16 6.545 4.976 11.930 1.00 0.00 C ATOM 237 CD PRO A 16 6.552 3.496 11.563 1.00 0.00 C ATOM 0 HA PRO A 16 3.367 4.031 11.678 1.00 0.00 H new ATOM 0 HB2 PRO A 16 4.831 6.318 12.014 1.00 0.00 H new ATOM 0 HB3 PRO A 16 4.810 5.070 13.244 1.00 0.00 H new ATOM 0 HG2 PRO A 16 6.933 5.592 11.119 1.00 0.00 H new ATOM 0 HG3 PRO A 16 7.164 5.175 12.805 1.00 0.00 H new ATOM 0 HD2 PRO A 16 7.329 3.278 10.830 1.00 0.00 H new ATOM 0 HD3 PRO A 16 6.755 2.877 12.437 1.00 0.00 H new ATOM 245 N ILE A 17 2.667 5.131 9.608 1.00 0.00 N ATOM 246 CA ILE A 17 2.189 5.745 8.371 1.00 0.00 C ATOM 247 C ILE A 17 2.722 7.178 8.275 1.00 0.00 C ATOM 248 O ILE A 17 2.841 7.901 9.267 1.00 0.00 O ATOM 249 CB ILE A 17 0.645 5.682 8.284 1.00 0.00 C ATOM 250 CG1 ILE A 17 0.115 5.975 6.865 1.00 0.00 C ATOM 251 CG2 ILE A 17 0.003 6.576 9.339 1.00 0.00 C ATOM 252 CD1 ILE A 17 -1.301 5.416 6.652 1.00 0.00 C ATOM 0 H ILE A 17 1.918 4.788 10.209 1.00 0.00 H new ATOM 0 HA ILE A 17 2.568 5.187 7.515 1.00 0.00 H new ATOM 0 HB ILE A 17 0.352 4.655 8.500 1.00 0.00 H new ATOM 0 HG12 ILE A 17 0.109 7.052 6.696 1.00 0.00 H new ATOM 0 HG13 ILE A 17 0.791 5.540 6.129 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -1.082 6.514 9.257 1.00 0.00 H new ATOM 0 HG22 ILE A 17 0.311 6.247 10.331 1.00 0.00 H new ATOM 0 HG23 ILE A 17 0.320 7.607 9.184 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -1.634 5.645 5.640 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -1.291 4.335 6.795 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -1.983 5.870 7.370 1.00 0.00 H new ATOM 264 N SER A 18 3.048 7.589 7.063 1.00 0.00 N ATOM 265 CA SER A 18 3.579 8.891 6.752 1.00 0.00 C ATOM 266 C SER A 18 2.468 9.770 6.189 1.00 0.00 C ATOM 267 O SER A 18 1.373 9.308 5.849 1.00 0.00 O ATOM 268 CB SER A 18 4.712 8.710 5.746 1.00 0.00 C ATOM 269 OG SER A 18 5.811 9.516 6.126 1.00 0.00 O ATOM 0 H SER A 18 2.943 6.996 6.240 1.00 0.00 H new ATOM 0 HA SER A 18 3.969 9.381 7.644 1.00 0.00 H new ATOM 0 HB2 SER A 18 5.012 7.663 5.704 1.00 0.00 H new ATOM 0 HB3 SER A 18 4.374 8.985 4.747 1.00 0.00 H new ATOM 0 HG SER A 18 6.121 9.248 7.016 1.00 0.00 H new ATOM 275 N GLU A 19 2.749 11.066 6.072 1.00 0.00 N ATOM 276 CA GLU A 19 1.732 12.006 5.643 1.00 0.00 C ATOM 277 C GLU A 19 1.607 12.054 4.130 1.00 0.00 C ATOM 278 O GLU A 19 0.491 12.136 3.601 1.00 0.00 O ATOM 279 CB GLU A 19 2.024 13.409 6.180 1.00 0.00 C ATOM 280 CG GLU A 19 1.591 13.551 7.643 1.00 0.00 C ATOM 281 CD GLU A 19 2.776 13.741 8.576 1.00 0.00 C ATOM 282 OE1 GLU A 19 3.553 14.699 8.389 1.00 0.00 O ATOM 283 OE2 GLU A 19 2.888 12.952 9.540 1.00 0.00 O ATOM 0 H GLU A 19 3.661 11.479 6.267 1.00 0.00 H new ATOM 0 HA GLU A 19 0.784 11.655 6.052 1.00 0.00 H new ATOM 0 HB2 GLU A 19 3.090 13.619 6.093 1.00 0.00 H new ATOM 0 HB3 GLU A 19 1.503 14.148 5.572 1.00 0.00 H new ATOM 0 HG2 GLU A 19 0.915 14.401 7.739 1.00 0.00 H new ATOM 0 HG3 GLU A 19 1.033 12.664 7.943 1.00 0.00 H new ATOM 290 N HIS A 20 2.735 12.014 3.430 1.00 0.00 N ATOM 291 CA HIS A 20 2.824 12.194 1.988 1.00 0.00 C ATOM 292 C HIS A 20 2.964 10.825 1.336 1.00 0.00 C ATOM 293 O HIS A 20 3.059 9.801 2.010 1.00 0.00 O ATOM 294 CB HIS A 20 4.013 13.144 1.721 1.00 0.00 C ATOM 295 CG HIS A 20 3.858 14.455 2.466 1.00 0.00 C ATOM 296 ND1 HIS A 20 2.948 15.462 2.180 1.00 0.00 N ATOM 297 CD2 HIS A 20 4.443 14.752 3.666 1.00 0.00 C ATOM 298 CE1 HIS A 20 2.977 16.343 3.200 1.00 0.00 C ATOM 299 NE2 HIS A 20 3.874 15.926 4.112 1.00 0.00 N ATOM 0 H HIS A 20 3.642 11.850 3.866 1.00 0.00 H new ATOM 0 HA HIS A 20 1.933 12.648 1.554 1.00 0.00 H new ATOM 0 HB2 HIS A 20 4.941 12.660 2.024 1.00 0.00 H new ATOM 0 HB3 HIS A 20 4.090 13.340 0.651 1.00 0.00 H new ATOM 0 HD2 HIS A 20 5.206 14.176 4.169 1.00 0.00 H new ATOM 0 HE1 HIS A 20 2.377 17.238 3.273 1.00 0.00 H new ATOM 0 HE2 HIS A 20 4.096 16.400 4.988 1.00 0.00 H new ATOM 308 N PHE A 21 2.903 10.800 0.012 1.00 0.00 N ATOM 309 CA PHE A 21 3.147 9.620 -0.807 1.00 0.00 C ATOM 310 C PHE A 21 4.315 9.932 -1.730 1.00 0.00 C ATOM 311 O PHE A 21 5.330 9.251 -1.725 1.00 0.00 O ATOM 312 CB PHE A 21 1.861 9.262 -1.546 1.00 0.00 C ATOM 313 CG PHE A 21 2.000 8.116 -2.525 1.00 0.00 C ATOM 314 CD1 PHE A 21 2.510 8.343 -3.819 1.00 0.00 C ATOM 315 CD2 PHE A 21 1.626 6.816 -2.143 1.00 0.00 C ATOM 316 CE1 PHE A 21 2.635 7.273 -4.721 1.00 0.00 C ATOM 317 CE2 PHE A 21 1.758 5.752 -3.049 1.00 0.00 C ATOM 318 CZ PHE A 21 2.267 5.982 -4.331 1.00 0.00 C ATOM 0 H PHE A 21 2.675 11.627 -0.540 1.00 0.00 H new ATOM 0 HA PHE A 21 3.418 8.746 -0.215 1.00 0.00 H new ATOM 0 HB2 PHE A 21 1.095 9.007 -0.814 1.00 0.00 H new ATOM 0 HB3 PHE A 21 1.508 10.142 -2.084 1.00 0.00 H new ATOM 0 HD1 PHE A 21 2.804 9.338 -4.117 1.00 0.00 H new ATOM 0 HD2 PHE A 21 1.237 6.636 -1.152 1.00 0.00 H new ATOM 0 HE1 PHE A 21 3.016 7.448 -5.716 1.00 0.00 H new ATOM 0 HE2 PHE A 21 1.466 4.754 -2.756 1.00 0.00 H new ATOM 0 HZ PHE A 21 2.376 5.159 -5.022 1.00 0.00 H new ATOM 328 N GLY A 22 4.216 11.060 -2.442 1.00 0.00 N ATOM 329 CA GLY A 22 5.305 11.614 -3.242 1.00 0.00 C ATOM 330 C GLY A 22 6.556 11.978 -2.432 1.00 0.00 C ATOM 331 O GLY A 22 7.561 12.352 -3.026 1.00 0.00 O ATOM 0 H GLY A 22 3.363 11.619 -2.477 1.00 0.00 H new ATOM 0 HA2 GLY A 22 5.581 10.892 -4.011 1.00 0.00 H new ATOM 0 HA3 GLY A 22 4.946 12.506 -3.756 1.00 0.00 H new ATOM 335 N ARG A 23 6.506 11.904 -1.095 1.00 0.00 N ATOM 336 CA ARG A 23 7.641 12.043 -0.183 1.00 0.00 C ATOM 337 C ARG A 23 7.460 11.103 1.009 1.00 0.00 C ATOM 338 O ARG A 23 7.775 11.406 2.153 1.00 0.00 O ATOM 339 CB ARG A 23 7.727 13.510 0.257 1.00 0.00 C ATOM 340 CG ARG A 23 9.009 13.745 1.062 1.00 0.00 C ATOM 341 CD ARG A 23 9.534 15.147 0.866 1.00 0.00 C ATOM 342 NE ARG A 23 8.885 16.097 1.787 1.00 0.00 N ATOM 343 CZ ARG A 23 8.036 17.095 1.511 1.00 0.00 C ATOM 344 NH1 ARG A 23 7.688 17.362 0.255 1.00 0.00 N ATOM 345 NH2 ARG A 23 7.523 17.803 2.514 1.00 0.00 N ATOM 0 H ARG A 23 5.630 11.738 -0.600 1.00 0.00 H new ATOM 0 HA ARG A 23 8.574 11.769 -0.676 1.00 0.00 H new ATOM 0 HB2 ARG A 23 7.713 14.161 -0.617 1.00 0.00 H new ATOM 0 HB3 ARG A 23 6.857 13.768 0.861 1.00 0.00 H new ATOM 0 HG2 ARG A 23 8.812 13.573 2.120 1.00 0.00 H new ATOM 0 HG3 ARG A 23 9.768 13.025 0.758 1.00 0.00 H new ATOM 0 HD2 ARG A 23 10.612 15.160 1.028 1.00 0.00 H new ATOM 0 HD3 ARG A 23 9.362 15.461 -0.164 1.00 0.00 H new ATOM 0 HE ARG A 23 9.115 15.977 2.774 1.00 0.00 H new ATOM 0 HH11 ARG A 23 8.069 16.804 -0.509 1.00 0.00 H new ATOM 0 HH12 ARG A 23 7.040 18.125 0.056 1.00 0.00 H new ATOM 0 HH21 ARG A 23 7.778 17.582 3.477 1.00 0.00 H new ATOM 0 HH22 ARG A 23 6.875 18.566 2.320 1.00 0.00 H new ATOM 359 N ALA A 24 6.964 9.923 0.705 1.00 0.00 N ATOM 360 CA ALA A 24 7.050 8.787 1.604 1.00 0.00 C ATOM 361 C ALA A 24 8.485 8.278 1.492 1.00 0.00 C ATOM 362 O ALA A 24 8.911 8.036 0.365 1.00 0.00 O ATOM 363 CB ALA A 24 6.057 7.707 1.188 1.00 0.00 C ATOM 0 H ALA A 24 6.488 9.722 -0.174 1.00 0.00 H new ATOM 0 HA ALA A 24 6.806 9.062 2.630 1.00 0.00 H new ATOM 0 HB1 ALA A 24 6.132 6.861 1.871 1.00 0.00 H new ATOM 0 HB2 ALA A 24 5.045 8.111 1.221 1.00 0.00 H new ATOM 0 HB3 ALA A 24 6.283 7.376 0.174 1.00 0.00 H new ATOM 369 N PRO A 25 9.259 8.169 2.576 1.00 0.00 N ATOM 370 CA PRO A 25 10.587 7.577 2.497 1.00 0.00 C ATOM 371 C PRO A 25 10.546 6.063 2.239 1.00 0.00 C ATOM 372 O PRO A 25 11.533 5.510 1.758 1.00 0.00 O ATOM 373 CB PRO A 25 11.275 7.949 3.808 1.00 0.00 C ATOM 374 CG PRO A 25 10.140 8.267 4.783 1.00 0.00 C ATOM 375 CD PRO A 25 8.947 8.641 3.913 1.00 0.00 C ATOM 0 HA PRO A 25 11.146 7.961 1.644 1.00 0.00 H new ATOM 0 HB2 PRO A 25 11.891 7.128 4.176 1.00 0.00 H new ATOM 0 HB3 PRO A 25 11.933 8.808 3.677 1.00 0.00 H new ATOM 0 HG2 PRO A 25 9.912 7.407 5.413 1.00 0.00 H new ATOM 0 HG3 PRO A 25 10.412 9.086 5.448 1.00 0.00 H new ATOM 0 HD2 PRO A 25 8.033 8.179 4.286 1.00 0.00 H new ATOM 0 HD3 PRO A 25 8.784 9.719 3.918 1.00 0.00 H new ATOM 383 N TYR A 26 9.422 5.386 2.506 1.00 0.00 N ATOM 384 CA TYR A 26 9.288 3.943 2.351 1.00 0.00 C ATOM 385 C TYR A 26 7.838 3.595 1.953 1.00 0.00 C ATOM 386 O TYR A 26 6.931 4.401 2.181 1.00 0.00 O ATOM 387 CB TYR A 26 9.670 3.281 3.682 1.00 0.00 C ATOM 388 CG TYR A 26 10.956 3.712 4.376 1.00 0.00 C ATOM 389 CD1 TYR A 26 10.957 4.790 5.277 1.00 0.00 C ATOM 390 CD2 TYR A 26 12.139 2.976 4.200 1.00 0.00 C ATOM 391 CE1 TYR A 26 12.145 5.197 5.911 1.00 0.00 C ATOM 392 CE2 TYR A 26 13.331 3.371 4.827 1.00 0.00 C ATOM 393 CZ TYR A 26 13.351 4.508 5.665 1.00 0.00 C ATOM 394 OH TYR A 26 14.517 4.926 6.233 1.00 0.00 O ATOM 0 H TYR A 26 8.571 5.838 2.840 1.00 0.00 H new ATOM 0 HA TYR A 26 9.947 3.576 1.564 1.00 0.00 H new ATOM 0 HB2 TYR A 26 8.848 3.445 4.379 1.00 0.00 H new ATOM 0 HB3 TYR A 26 9.733 2.207 3.510 1.00 0.00 H new ATOM 0 HD1 TYR A 26 10.035 5.312 5.485 1.00 0.00 H new ATOM 0 HD2 TYR A 26 12.131 2.095 3.575 1.00 0.00 H new ATOM 0 HE1 TYR A 26 12.134 6.039 6.588 1.00 0.00 H new ATOM 0 HE2 TYR A 26 14.236 2.804 4.668 1.00 0.00 H new ATOM 0 HH TYR A 26 15.247 4.334 5.955 1.00 0.00 H new ATOM 404 N PHE A 27 7.604 2.396 1.405 1.00 0.00 N ATOM 405 CA PHE A 27 6.288 1.875 1.016 1.00 0.00 C ATOM 406 C PHE A 27 6.189 0.430 1.484 1.00 0.00 C ATOM 407 O PHE A 27 6.818 -0.453 0.893 1.00 0.00 O ATOM 408 CB PHE A 27 6.051 1.901 -0.500 1.00 0.00 C ATOM 409 CG PHE A 27 5.945 3.276 -1.100 1.00 0.00 C ATOM 410 CD1 PHE A 27 4.909 4.131 -0.700 1.00 0.00 C ATOM 411 CD2 PHE A 27 6.874 3.698 -2.067 1.00 0.00 C ATOM 412 CE1 PHE A 27 4.798 5.404 -1.273 1.00 0.00 C ATOM 413 CE2 PHE A 27 6.759 4.965 -2.650 1.00 0.00 C ATOM 414 CZ PHE A 27 5.717 5.821 -2.251 1.00 0.00 C ATOM 0 H PHE A 27 8.357 1.736 1.213 1.00 0.00 H new ATOM 0 HA PHE A 27 5.537 2.516 1.477 1.00 0.00 H new ATOM 0 HB2 PHE A 27 6.866 1.368 -0.990 1.00 0.00 H new ATOM 0 HB3 PHE A 27 5.135 1.353 -0.719 1.00 0.00 H new ATOM 0 HD1 PHE A 27 4.199 3.809 0.047 1.00 0.00 H new ATOM 0 HD2 PHE A 27 7.680 3.042 -2.361 1.00 0.00 H new ATOM 0 HE1 PHE A 27 4.004 6.067 -0.962 1.00 0.00 H new ATOM 0 HE2 PHE A 27 7.466 5.283 -3.402 1.00 0.00 H new ATOM 0 HZ PHE A 27 5.623 6.800 -2.697 1.00 0.00 H new ATOM 424 N ALA A 28 5.407 0.193 2.533 1.00 0.00 N ATOM 425 CA ALA A 28 5.134 -1.135 3.039 1.00 0.00 C ATOM 426 C ALA A 28 4.065 -1.740 2.147 1.00 0.00 C ATOM 427 O ALA A 28 2.884 -1.466 2.349 1.00 0.00 O ATOM 428 CB ALA A 28 4.688 -1.050 4.502 1.00 0.00 C ATOM 0 H ALA A 28 4.942 0.933 3.058 1.00 0.00 H new ATOM 0 HA ALA A 28 6.022 -1.767 3.019 1.00 0.00 H new ATOM 0 HB1 ALA A 28 4.484 -2.052 4.879 1.00 0.00 H new ATOM 0 HB2 ALA A 28 5.478 -0.593 5.097 1.00 0.00 H new ATOM 0 HB3 ALA A 28 3.784 -0.445 4.572 1.00 0.00 H new ATOM 434 N PHE A 29 4.464 -2.490 1.121 1.00 0.00 N ATOM 435 CA PHE A 29 3.562 -3.272 0.287 1.00 0.00 C ATOM 436 C PHE A 29 3.267 -4.591 1.000 1.00 0.00 C ATOM 437 O PHE A 29 4.045 -5.538 0.966 1.00 0.00 O ATOM 438 CB PHE A 29 4.126 -3.452 -1.131 1.00 0.00 C ATOM 439 CG PHE A 29 3.540 -2.518 -2.184 1.00 0.00 C ATOM 440 CD1 PHE A 29 2.145 -2.389 -2.370 1.00 0.00 C ATOM 441 CD2 PHE A 29 4.395 -1.775 -3.012 1.00 0.00 C ATOM 442 CE1 PHE A 29 1.616 -1.490 -3.310 1.00 0.00 C ATOM 443 CE2 PHE A 29 3.864 -0.997 -4.049 1.00 0.00 C ATOM 444 CZ PHE A 29 2.480 -0.822 -4.186 1.00 0.00 C ATOM 0 H PHE A 29 5.442 -2.571 0.844 1.00 0.00 H new ATOM 0 HA PHE A 29 2.618 -2.745 0.148 1.00 0.00 H new ATOM 0 HB2 PHE A 29 5.205 -3.304 -1.097 1.00 0.00 H new ATOM 0 HB3 PHE A 29 3.955 -4.482 -1.445 1.00 0.00 H new ATOM 0 HD1 PHE A 29 1.473 -2.993 -1.778 1.00 0.00 H new ATOM 0 HD2 PHE A 29 5.462 -1.803 -2.850 1.00 0.00 H new ATOM 0 HE1 PHE A 29 0.551 -1.315 -3.357 1.00 0.00 H new ATOM 0 HE2 PHE A 29 4.532 -0.524 -4.754 1.00 0.00 H new ATOM 0 HZ PHE A 29 2.085 -0.179 -4.959 1.00 0.00 H new ATOM 454 N VAL A 30 2.161 -4.633 1.720 1.00 0.00 N ATOM 455 CA VAL A 30 1.652 -5.821 2.393 1.00 0.00 C ATOM 456 C VAL A 30 0.947 -6.666 1.327 1.00 0.00 C ATOM 457 O VAL A 30 0.466 -6.123 0.342 1.00 0.00 O ATOM 458 CB VAL A 30 0.679 -5.315 3.497 1.00 0.00 C ATOM 459 CG1 VAL A 30 0.042 -6.432 4.320 1.00 0.00 C ATOM 460 CG2 VAL A 30 1.383 -4.313 4.431 1.00 0.00 C ATOM 0 H VAL A 30 1.569 -3.814 1.859 1.00 0.00 H new ATOM 0 HA VAL A 30 2.421 -6.436 2.861 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.133 -4.819 2.965 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -0.622 -5.999 5.068 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -0.529 -7.088 3.663 1.00 0.00 H new ATOM 0 HG13 VAL A 30 0.822 -7.008 4.818 1.00 0.00 H new ATOM 0 HG21 VAL A 30 0.683 -3.973 5.194 1.00 0.00 H new ATOM 0 HG22 VAL A 30 2.234 -4.798 4.909 1.00 0.00 H new ATOM 0 HG23 VAL A 30 1.731 -3.458 3.851 1.00 0.00 H new ATOM 470 N LYS A 31 0.883 -7.992 1.474 1.00 0.00 N ATOM 471 CA LYS A 31 0.208 -8.865 0.510 1.00 0.00 C ATOM 472 C LYS A 31 -1.145 -9.314 1.063 1.00 0.00 C ATOM 473 O LYS A 31 -1.580 -8.825 2.105 1.00 0.00 O ATOM 474 CB LYS A 31 1.189 -9.984 0.111 1.00 0.00 C ATOM 475 CG LYS A 31 2.360 -9.370 -0.676 1.00 0.00 C ATOM 476 CD LYS A 31 2.883 -10.296 -1.779 1.00 0.00 C ATOM 477 CE LYS A 31 1.922 -10.170 -2.969 1.00 0.00 C ATOM 478 NZ LYS A 31 2.289 -10.938 -4.174 1.00 0.00 N ATOM 0 H LYS A 31 1.297 -8.490 2.263 1.00 0.00 H new ATOM 0 HA LYS A 31 -0.050 -8.349 -0.415 1.00 0.00 H new ATOM 0 HB2 LYS A 31 1.560 -10.494 1.000 1.00 0.00 H new ATOM 0 HB3 LYS A 31 0.679 -10.732 -0.496 1.00 0.00 H new ATOM 0 HG2 LYS A 31 2.039 -8.428 -1.120 1.00 0.00 H new ATOM 0 HG3 LYS A 31 3.172 -9.137 0.012 1.00 0.00 H new ATOM 0 HD2 LYS A 31 3.895 -10.015 -2.070 1.00 0.00 H new ATOM 0 HD3 LYS A 31 2.927 -11.327 -1.427 1.00 0.00 H new ATOM 0 HE2 LYS A 31 0.931 -10.488 -2.646 1.00 0.00 H new ATOM 0 HE3 LYS A 31 1.846 -9.117 -3.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 1.576 -10.783 -4.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 3.219 -10.623 -4.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 2.331 -11.951 -3.941 1.00 0.00 H new ATOM 492 N VAL A 32 -1.850 -10.210 0.363 1.00 0.00 N ATOM 493 CA VAL A 32 -2.982 -10.921 0.946 1.00 0.00 C ATOM 494 C VAL A 32 -3.043 -12.331 0.359 1.00 0.00 C ATOM 495 O VAL A 32 -2.915 -12.525 -0.854 1.00 0.00 O ATOM 496 CB VAL A 32 -4.337 -10.203 0.710 1.00 0.00 C ATOM 497 CG1 VAL A 32 -5.424 -10.736 1.656 1.00 0.00 C ATOM 498 CG2 VAL A 32 -4.336 -8.685 0.900 1.00 0.00 C ATOM 0 H VAL A 32 -1.653 -10.456 -0.607 1.00 0.00 H new ATOM 0 HA VAL A 32 -2.824 -10.953 2.024 1.00 0.00 H new ATOM 0 HB VAL A 32 -4.533 -10.418 -0.340 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -6.361 -10.213 1.465 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -5.563 -11.803 1.485 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -5.120 -10.571 2.690 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -5.335 -8.294 0.709 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -4.042 -8.446 1.922 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -3.630 -8.232 0.205 1.00 0.00 H new ATOM 508 N LYS A 33 -3.307 -13.314 1.219 1.00 0.00 N ATOM 509 CA LYS A 33 -3.564 -14.710 0.890 1.00 0.00 C ATOM 510 C LYS A 33 -4.637 -15.161 1.864 1.00 0.00 C ATOM 511 O LYS A 33 -4.435 -15.019 3.067 1.00 0.00 O ATOM 512 CB LYS A 33 -2.272 -15.524 1.084 1.00 0.00 C ATOM 513 CG LYS A 33 -2.384 -17.002 0.685 1.00 0.00 C ATOM 514 CD LYS A 33 -1.753 -17.954 1.710 1.00 0.00 C ATOM 515 CE LYS A 33 -2.722 -18.235 2.860 1.00 0.00 C ATOM 516 NZ LYS A 33 -2.148 -19.159 3.859 1.00 0.00 N ATOM 0 H LYS A 33 -3.349 -13.144 2.224 1.00 0.00 H new ATOM 0 HA LYS A 33 -3.885 -14.847 -0.143 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -1.476 -15.063 0.500 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -1.974 -15.465 2.131 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -3.436 -17.259 0.559 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -1.902 -17.148 -0.282 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -1.479 -18.890 1.223 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -0.834 -17.517 2.101 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -2.988 -17.296 3.346 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -3.643 -18.660 2.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -2.839 -19.321 4.619 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -1.917 -20.064 3.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -1.283 -18.743 4.260 1.00 0.00 H new ATOM 530 N ASN A 34 -5.752 -15.710 1.383 1.00 0.00 N ATOM 531 CA ASN A 34 -6.842 -16.203 2.235 1.00 0.00 C ATOM 532 C ASN A 34 -7.332 -15.145 3.239 1.00 0.00 C ATOM 533 O ASN A 34 -7.589 -15.443 4.405 1.00 0.00 O ATOM 534 CB ASN A 34 -6.413 -17.515 2.910 1.00 0.00 C ATOM 535 CG ASN A 34 -7.618 -18.337 3.339 1.00 0.00 C ATOM 536 OD1 ASN A 34 -8.287 -18.910 2.483 1.00 0.00 O ATOM 537 ND2 ASN A 34 -7.909 -18.433 4.623 1.00 0.00 N ATOM 0 H ASN A 34 -5.929 -15.827 0.385 1.00 0.00 H new ATOM 0 HA ASN A 34 -7.707 -16.411 1.605 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -5.800 -18.097 2.222 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -5.794 -17.293 3.779 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -8.706 -18.993 4.925 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -7.337 -17.947 5.313 1.00 0.00 H new ATOM 544 N ASN A 35 -7.415 -13.885 2.792 1.00 0.00 N ATOM 545 CA ASN A 35 -7.740 -12.682 3.582 1.00 0.00 C ATOM 546 C ASN A 35 -6.796 -12.423 4.764 1.00 0.00 C ATOM 547 O ASN A 35 -7.108 -11.594 5.616 1.00 0.00 O ATOM 548 CB ASN A 35 -9.205 -12.686 4.053 1.00 0.00 C ATOM 549 CG ASN A 35 -9.846 -11.306 3.927 1.00 0.00 C ATOM 550 OD1 ASN A 35 -10.709 -11.087 3.082 1.00 0.00 O ATOM 551 ND2 ASN A 35 -9.435 -10.335 4.724 1.00 0.00 N ATOM 0 H ASN A 35 -7.248 -13.661 1.811 1.00 0.00 H new ATOM 0 HA ASN A 35 -7.591 -11.852 2.891 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -9.774 -13.406 3.464 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -9.252 -13.015 5.091 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -9.835 -9.401 4.638 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -8.718 -10.520 5.425 1.00 0.00 H new ATOM 558 N ALA A 36 -5.660 -13.108 4.841 1.00 0.00 N ATOM 559 CA ALA A 36 -4.609 -12.876 5.816 1.00 0.00 C ATOM 560 C ALA A 36 -3.445 -12.169 5.108 1.00 0.00 C ATOM 561 O ALA A 36 -3.430 -12.126 3.877 1.00 0.00 O ATOM 562 CB ALA A 36 -4.199 -14.225 6.406 1.00 0.00 C ATOM 0 H ALA A 36 -5.441 -13.870 4.199 1.00 0.00 H new ATOM 0 HA ALA A 36 -4.941 -12.238 6.635 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -3.409 -14.075 7.142 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -5.060 -14.689 6.887 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -3.835 -14.875 5.610 1.00 0.00 H new ATOM 568 N ILE A 37 -2.457 -11.649 5.844 1.00 0.00 N ATOM 569 CA ILE A 37 -1.462 -10.681 5.364 1.00 0.00 C ATOM 570 C ILE A 37 -0.549 -11.279 4.288 1.00 0.00 C ATOM 571 O ILE A 37 0.039 -10.548 3.503 1.00 0.00 O ATOM 572 CB ILE A 37 -0.689 -10.126 6.600 1.00 0.00 C ATOM 573 CG1 ILE A 37 -1.389 -8.883 7.195 1.00 0.00 C ATOM 574 CG2 ILE A 37 0.788 -9.768 6.356 1.00 0.00 C ATOM 575 CD1 ILE A 37 -2.815 -9.128 7.707 1.00 0.00 C ATOM 0 H ILE A 37 -2.323 -11.898 6.824 1.00 0.00 H new ATOM 0 HA ILE A 37 -1.958 -9.849 4.864 1.00 0.00 H new ATOM 0 HB ILE A 37 -0.703 -10.964 7.297 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -0.784 -8.502 8.017 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -1.421 -8.103 6.434 1.00 0.00 H new ATOM 0 HG21 ILE A 37 1.229 -9.393 7.280 1.00 0.00 H new ATOM 0 HG22 ILE A 37 1.329 -10.657 6.031 1.00 0.00 H new ATOM 0 HG23 ILE A 37 0.854 -9.001 5.585 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -3.223 -8.199 8.105 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -3.441 -9.477 6.886 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -2.795 -9.882 8.494 1.00 0.00 H new ATOM 587 N ALA A 38 -0.469 -12.604 4.188 1.00 0.00 N ATOM 588 CA ALA A 38 0.509 -13.372 3.428 1.00 0.00 C ATOM 589 C ALA A 38 1.963 -13.002 3.738 1.00 0.00 C ATOM 590 O ALA A 38 2.688 -13.858 4.237 1.00 0.00 O ATOM 591 CB ALA A 38 0.211 -13.289 1.934 1.00 0.00 C ATOM 0 H ALA A 38 -1.133 -13.209 4.670 1.00 0.00 H new ATOM 0 HA ALA A 38 0.405 -14.408 3.750 1.00 0.00 H new ATOM 0 HB1 ALA A 38 0.951 -13.868 1.383 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -0.783 -13.691 1.738 1.00 0.00 H new ATOM 0 HB3 ALA A 38 0.251 -12.248 1.612 1.00 0.00 H new ATOM 597 N ASP A 39 2.408 -11.792 3.397 1.00 0.00 N ATOM 598 CA ASP A 39 3.731 -11.260 3.729 1.00 0.00 C ATOM 599 C ASP A 39 3.755 -9.735 3.646 1.00 0.00 C ATOM 600 O ASP A 39 2.750 -9.127 3.272 1.00 0.00 O ATOM 601 CB ASP A 39 4.782 -11.834 2.771 1.00 0.00 C ATOM 602 CG ASP A 39 6.050 -12.211 3.543 1.00 0.00 C ATOM 603 OD1 ASP A 39 5.943 -12.917 4.573 1.00 0.00 O ATOM 604 OD2 ASP A 39 7.155 -11.739 3.204 1.00 0.00 O ATOM 0 H ASP A 39 1.839 -11.134 2.865 1.00 0.00 H new ATOM 0 HA ASP A 39 3.960 -11.555 4.753 1.00 0.00 H new ATOM 0 HB2 ASP A 39 4.382 -12.712 2.264 1.00 0.00 H new ATOM 0 HB3 ASP A 39 5.021 -11.101 2.000 1.00 0.00 H new ATOM 609 N ILE A 40 4.896 -9.110 3.950 1.00 0.00 N ATOM 610 CA ILE A 40 5.088 -7.668 3.834 1.00 0.00 C ATOM 611 C ILE A 40 6.399 -7.405 3.111 1.00 0.00 C ATOM 612 O ILE A 40 7.397 -8.094 3.337 1.00 0.00 O ATOM 613 CB ILE A 40 5.021 -7.003 5.232 1.00 0.00 C ATOM 614 CG1 ILE A 40 3.590 -7.197 5.774 1.00 0.00 C ATOM 615 CG2 ILE A 40 5.468 -5.525 5.241 1.00 0.00 C ATOM 616 CD1 ILE A 40 3.191 -6.336 6.966 1.00 0.00 C ATOM 0 H ILE A 40 5.723 -9.602 4.288 1.00 0.00 H new ATOM 0 HA ILE A 40 4.288 -7.219 3.245 1.00 0.00 H new ATOM 0 HB ILE A 40 5.740 -7.489 5.891 1.00 0.00 H new ATOM 0 HG12 ILE A 40 2.889 -7.002 4.963 1.00 0.00 H new ATOM 0 HG13 ILE A 40 3.470 -8.244 6.054 1.00 0.00 H new ATOM 0 HG21 ILE A 40 5.394 -5.129 6.254 1.00 0.00 H new ATOM 0 HG22 ILE A 40 6.501 -5.455 4.899 1.00 0.00 H new ATOM 0 HG23 ILE A 40 4.826 -4.947 4.577 1.00 0.00 H new ATOM 0 HD11 ILE A 40 2.165 -6.565 7.253 1.00 0.00 H new ATOM 0 HD12 ILE A 40 3.857 -6.544 7.804 1.00 0.00 H new ATOM 0 HD13 ILE A 40 3.266 -5.283 6.695 1.00 0.00 H new ATOM 628 N SER A 41 6.381 -6.372 2.283 1.00 0.00 N ATOM 629 CA SER A 41 7.490 -5.795 1.562 1.00 0.00 C ATOM 630 C SER A 41 7.723 -4.401 2.129 1.00 0.00 C ATOM 631 O SER A 41 7.093 -3.455 1.659 1.00 0.00 O ATOM 632 CB SER A 41 7.082 -5.726 0.090 1.00 0.00 C ATOM 633 OG SER A 41 6.785 -7.015 -0.401 1.00 0.00 O ATOM 0 H SER A 41 5.511 -5.878 2.086 1.00 0.00 H new ATOM 0 HA SER A 41 8.407 -6.377 1.656 1.00 0.00 H new ATOM 0 HB2 SER A 41 6.213 -5.078 -0.023 1.00 0.00 H new ATOM 0 HB3 SER A 41 7.887 -5.284 -0.496 1.00 0.00 H new ATOM 0 HG SER A 41 6.524 -6.954 -1.344 1.00 0.00 H new ATOM 639 N VAL A 42 8.547 -4.264 3.168 1.00 0.00 N ATOM 640 CA VAL A 42 8.897 -2.961 3.717 1.00 0.00 C ATOM 641 C VAL A 42 10.106 -2.437 2.934 1.00 0.00 C ATOM 642 O VAL A 42 11.251 -2.422 3.397 1.00 0.00 O ATOM 643 CB VAL A 42 8.990 -3.005 5.255 1.00 0.00 C ATOM 644 CG1 VAL A 42 10.026 -3.963 5.849 1.00 0.00 C ATOM 645 CG2 VAL A 42 9.196 -1.591 5.811 1.00 0.00 C ATOM 0 H VAL A 42 8.986 -5.050 3.648 1.00 0.00 H new ATOM 0 HA VAL A 42 8.115 -2.215 3.576 1.00 0.00 H new ATOM 0 HB VAL A 42 8.032 -3.420 5.570 1.00 0.00 H new ATOM 0 HG11 VAL A 42 9.995 -3.903 6.937 1.00 0.00 H new ATOM 0 HG12 VAL A 42 9.801 -4.982 5.535 1.00 0.00 H new ATOM 0 HG13 VAL A 42 11.020 -3.686 5.498 1.00 0.00 H new ATOM 0 HG21 VAL A 42 9.260 -1.633 6.898 1.00 0.00 H new ATOM 0 HG22 VAL A 42 10.119 -1.173 5.409 1.00 0.00 H new ATOM 0 HG23 VAL A 42 8.355 -0.960 5.522 1.00 0.00 H new ATOM 655 N GLU A 43 9.850 -2.028 1.693 1.00 0.00 N ATOM 656 CA GLU A 43 10.881 -1.589 0.770 1.00 0.00 C ATOM 657 C GLU A 43 11.078 -0.085 0.986 1.00 0.00 C ATOM 658 O GLU A 43 10.127 0.647 1.310 1.00 0.00 O ATOM 659 CB GLU A 43 10.479 -1.843 -0.695 1.00 0.00 C ATOM 660 CG GLU A 43 9.729 -3.140 -1.035 1.00 0.00 C ATOM 661 CD GLU A 43 10.611 -4.377 -1.153 1.00 0.00 C ATOM 662 OE1 GLU A 43 11.285 -4.762 -0.174 1.00 0.00 O ATOM 663 OE2 GLU A 43 10.595 -4.991 -2.243 1.00 0.00 O ATOM 0 H GLU A 43 8.909 -1.994 1.301 1.00 0.00 H new ATOM 0 HA GLU A 43 11.797 -2.148 0.960 1.00 0.00 H new ATOM 0 HB2 GLU A 43 9.859 -1.007 -1.018 1.00 0.00 H new ATOM 0 HB3 GLU A 43 11.387 -1.818 -1.297 1.00 0.00 H new ATOM 0 HG2 GLU A 43 8.976 -3.320 -0.267 1.00 0.00 H new ATOM 0 HG3 GLU A 43 9.197 -2.999 -1.976 1.00 0.00 H new ATOM 670 N GLU A 44 12.284 0.403 0.731 1.00 0.00 N ATOM 671 CA GLU A 44 12.626 1.816 0.706 1.00 0.00 C ATOM 672 C GLU A 44 12.063 2.464 -0.559 1.00 0.00 C ATOM 673 O GLU A 44 11.932 1.795 -1.587 1.00 0.00 O ATOM 674 CB GLU A 44 14.153 1.906 0.680 1.00 0.00 C ATOM 675 CG GLU A 44 14.773 1.423 1.994 1.00 0.00 C ATOM 676 CD GLU A 44 16.217 0.960 1.866 1.00 0.00 C ATOM 677 OE1 GLU A 44 16.901 1.301 0.869 1.00 0.00 O ATOM 678 OE2 GLU A 44 16.682 0.296 2.820 1.00 0.00 O ATOM 0 H GLU A 44 13.082 -0.200 0.528 1.00 0.00 H new ATOM 0 HA GLU A 44 12.212 2.329 1.574 1.00 0.00 H new ATOM 0 HB2 GLU A 44 14.538 1.308 -0.145 1.00 0.00 H new ATOM 0 HB3 GLU A 44 14.453 2.937 0.494 1.00 0.00 H new ATOM 0 HG2 GLU A 44 14.725 2.231 2.724 1.00 0.00 H new ATOM 0 HG3 GLU A 44 14.173 0.602 2.386 1.00 0.00 H new ATOM 685 N ASN A 45 11.734 3.756 -0.523 1.00 0.00 N ATOM 686 CA ASN A 45 11.283 4.483 -1.709 1.00 0.00 C ATOM 687 C ASN A 45 12.520 4.925 -2.506 1.00 0.00 C ATOM 688 O ASN A 45 13.300 5.722 -1.985 1.00 0.00 O ATOM 689 CB ASN A 45 10.427 5.700 -1.332 1.00 0.00 C ATOM 690 CG ASN A 45 9.900 6.463 -2.550 1.00 0.00 C ATOM 691 OD1 ASN A 45 10.219 6.196 -3.704 1.00 0.00 O ATOM 692 ND2 ASN A 45 9.050 7.445 -2.330 1.00 0.00 N ATOM 0 H ASN A 45 11.772 4.324 0.323 1.00 0.00 H new ATOM 0 HA ASN A 45 10.658 3.827 -2.314 1.00 0.00 H new ATOM 0 HB2 ASN A 45 9.584 5.370 -0.725 1.00 0.00 H new ATOM 0 HB3 ASN A 45 11.019 6.376 -0.715 1.00 0.00 H new ATOM 0 HD21 ASN A 45 8.666 7.972 -3.114 1.00 0.00 H new ATOM 0 HD22 ASN A 45 8.776 7.678 -1.376 1.00 0.00 H new ATOM 699 N PRO A 46 12.722 4.449 -3.744 1.00 0.00 N ATOM 700 CA PRO A 46 13.876 4.828 -4.558 1.00 0.00 C ATOM 701 C PRO A 46 13.876 6.297 -5.031 1.00 0.00 C ATOM 702 O PRO A 46 14.876 6.732 -5.596 1.00 0.00 O ATOM 703 CB PRO A 46 13.863 3.860 -5.742 1.00 0.00 C ATOM 704 CG PRO A 46 12.403 3.429 -5.866 1.00 0.00 C ATOM 705 CD PRO A 46 11.920 3.444 -4.428 1.00 0.00 C ATOM 0 HA PRO A 46 14.785 4.760 -3.961 1.00 0.00 H new ATOM 0 HB2 PRO A 46 14.213 4.343 -6.654 1.00 0.00 H new ATOM 0 HB3 PRO A 46 14.516 3.005 -5.563 1.00 0.00 H new ATOM 0 HG2 PRO A 46 11.831 4.115 -6.491 1.00 0.00 H new ATOM 0 HG3 PRO A 46 12.311 2.439 -6.312 1.00 0.00 H new ATOM 0 HD2 PRO A 46 10.859 3.690 -4.376 1.00 0.00 H new ATOM 0 HD3 PRO A 46 12.044 2.465 -3.965 1.00 0.00 H new ATOM 713 N LEU A 47 12.790 7.058 -4.840 1.00 0.00 N ATOM 714 CA LEU A 47 12.627 8.459 -5.254 1.00 0.00 C ATOM 715 C LEU A 47 11.977 9.262 -4.107 1.00 0.00 C ATOM 716 O LEU A 47 11.107 10.112 -4.333 1.00 0.00 O ATOM 717 CB LEU A 47 11.716 8.535 -6.505 1.00 0.00 C ATOM 718 CG LEU A 47 12.159 8.082 -7.895 1.00 0.00 C ATOM 719 CD1 LEU A 47 13.462 8.726 -8.330 1.00 0.00 C ATOM 720 CD2 LEU A 47 12.196 6.576 -8.097 1.00 0.00 C ATOM 0 H LEU A 47 11.960 6.696 -4.370 1.00 0.00 H new ATOM 0 HA LEU A 47 13.605 8.877 -5.491 1.00 0.00 H new ATOM 0 HB2 LEU A 47 10.818 7.964 -6.267 1.00 0.00 H new ATOM 0 HB3 LEU A 47 11.414 9.578 -6.603 1.00 0.00 H new ATOM 0 HG LEU A 47 11.366 8.443 -8.550 1.00 0.00 H new ATOM 0 HD11 LEU A 47 13.730 8.369 -9.324 1.00 0.00 H new ATOM 0 HD12 LEU A 47 13.342 9.809 -8.353 1.00 0.00 H new ATOM 0 HD13 LEU A 47 14.251 8.463 -7.625 1.00 0.00 H new ATOM 0 HD21 LEU A 47 12.522 6.353 -9.113 1.00 0.00 H new ATOM 0 HD22 LEU A 47 12.892 6.131 -7.387 1.00 0.00 H new ATOM 0 HD23 LEU A 47 11.200 6.163 -7.936 1.00 0.00 H new ATOM 732 N ALA A 48 12.352 9.018 -2.847 1.00 0.00 N ATOM 733 CA ALA A 48 11.789 9.714 -1.693 1.00 0.00 C ATOM 734 C ALA A 48 11.978 11.227 -1.791 1.00 0.00 C ATOM 735 O ALA A 48 11.129 11.977 -1.296 1.00 0.00 O ATOM 736 CB ALA A 48 12.474 9.210 -0.425 1.00 0.00 C ATOM 0 H ALA A 48 13.060 8.326 -2.601 1.00 0.00 H new ATOM 0 HA ALA A 48 10.719 9.509 -1.666 1.00 0.00 H new ATOM 0 HB1 ALA A 48 12.059 9.725 0.442 1.00 0.00 H new ATOM 0 HB2 ALA A 48 12.308 8.137 -0.324 1.00 0.00 H new ATOM 0 HB3 ALA A 48 13.544 9.407 -0.487 1.00 0.00 H new ATOM 830 N ALA A 55 8.245 9.501 -11.105 1.00 0.00 N ATOM 831 CA ALA A 55 8.933 8.215 -11.020 1.00 0.00 C ATOM 832 C ALA A 55 8.726 7.470 -9.696 1.00 0.00 C ATOM 833 O ALA A 55 8.895 6.252 -9.662 1.00 0.00 O ATOM 834 CB ALA A 55 10.415 8.440 -11.287 1.00 0.00 C ATOM 0 HA ALA A 55 8.492 7.565 -11.776 1.00 0.00 H new ATOM 0 HB1 ALA A 55 10.944 7.489 -11.227 1.00 0.00 H new ATOM 0 HB2 ALA A 55 10.545 8.866 -12.282 1.00 0.00 H new ATOM 0 HB3 ALA A 55 10.819 9.127 -10.543 1.00 0.00 H new ATOM 840 N VAL A 56 8.287 8.147 -8.630 1.00 0.00 N ATOM 841 CA VAL A 56 7.870 7.488 -7.388 1.00 0.00 C ATOM 842 C VAL A 56 6.793 6.415 -7.699 1.00 0.00 C ATOM 843 O VAL A 56 6.960 5.276 -7.259 1.00 0.00 O ATOM 844 CB VAL A 56 7.376 8.557 -6.371 1.00 0.00 C ATOM 845 CG1 VAL A 56 6.256 8.132 -5.422 1.00 0.00 C ATOM 846 CG2 VAL A 56 8.511 9.099 -5.521 1.00 0.00 C ATOM 0 H VAL A 56 8.211 9.164 -8.604 1.00 0.00 H new ATOM 0 HA VAL A 56 8.714 6.972 -6.931 1.00 0.00 H new ATOM 0 HB VAL A 56 6.960 9.318 -7.031 1.00 0.00 H new ATOM 0 HG11 VAL A 56 6.001 8.963 -4.764 1.00 0.00 H new ATOM 0 HG12 VAL A 56 5.378 7.845 -6.001 1.00 0.00 H new ATOM 0 HG13 VAL A 56 6.589 7.284 -4.823 1.00 0.00 H new ATOM 0 HG21 VAL A 56 8.122 9.842 -4.825 1.00 0.00 H new ATOM 0 HG22 VAL A 56 8.969 8.283 -4.962 1.00 0.00 H new ATOM 0 HG23 VAL A 56 9.259 9.562 -6.165 1.00 0.00 H new ATOM 856 N PRO A 57 5.700 6.719 -8.438 1.00 0.00 N ATOM 857 CA PRO A 57 4.685 5.729 -8.776 1.00 0.00 C ATOM 858 C PRO A 57 5.189 4.739 -9.828 1.00 0.00 C ATOM 859 O PRO A 57 4.721 3.606 -9.859 1.00 0.00 O ATOM 860 CB PRO A 57 3.495 6.498 -9.337 1.00 0.00 C ATOM 861 CG PRO A 57 4.026 7.865 -9.733 1.00 0.00 C ATOM 862 CD PRO A 57 5.408 7.976 -9.104 1.00 0.00 C ATOM 0 HA PRO A 57 4.422 5.152 -7.890 1.00 0.00 H new ATOM 0 HB2 PRO A 57 3.068 5.982 -10.197 1.00 0.00 H new ATOM 0 HB3 PRO A 57 2.703 6.588 -8.593 1.00 0.00 H new ATOM 0 HG2 PRO A 57 4.082 7.963 -10.817 1.00 0.00 H new ATOM 0 HG3 PRO A 57 3.369 8.658 -9.375 1.00 0.00 H new ATOM 0 HD2 PRO A 57 6.158 8.187 -9.866 1.00 0.00 H new ATOM 0 HD3 PRO A 57 5.437 8.801 -8.392 1.00 0.00 H new ATOM 870 N ASN A 58 6.118 5.154 -10.699 1.00 0.00 N ATOM 871 CA ASN A 58 6.678 4.299 -11.740 1.00 0.00 C ATOM 872 C ASN A 58 7.222 3.015 -11.114 1.00 0.00 C ATOM 873 O ASN A 58 6.871 1.923 -11.562 1.00 0.00 O ATOM 874 CB ASN A 58 7.746 5.062 -12.537 1.00 0.00 C ATOM 875 CG ASN A 58 8.193 4.319 -13.787 1.00 0.00 C ATOM 876 OD1 ASN A 58 8.634 3.180 -13.723 1.00 0.00 O ATOM 877 ND2 ASN A 58 8.085 4.949 -14.947 1.00 0.00 N ATOM 0 H ASN A 58 6.501 6.099 -10.697 1.00 0.00 H new ATOM 0 HA ASN A 58 5.898 4.015 -12.446 1.00 0.00 H new ATOM 0 HB2 ASN A 58 7.352 6.038 -12.821 1.00 0.00 H new ATOM 0 HB3 ASN A 58 8.611 5.241 -11.898 1.00 0.00 H new ATOM 0 HD21 ASN A 58 8.372 4.484 -15.808 1.00 0.00 H new ATOM 0 HD22 ASN A 58 7.715 5.899 -14.979 1.00 0.00 H new ATOM 884 N PHE A 59 7.955 3.160 -10.006 1.00 0.00 N ATOM 885 CA PHE A 59 8.395 2.049 -9.179 1.00 0.00 C ATOM 886 C PHE A 59 7.205 1.228 -8.672 1.00 0.00 C ATOM 887 O PHE A 59 7.044 0.084 -9.068 1.00 0.00 O ATOM 888 CB PHE A 59 9.277 2.581 -8.032 1.00 0.00 C ATOM 889 CG PHE A 59 9.333 1.658 -6.833 1.00 0.00 C ATOM 890 CD1 PHE A 59 9.819 0.347 -6.997 1.00 0.00 C ATOM 891 CD2 PHE A 59 8.765 2.054 -5.605 1.00 0.00 C ATOM 892 CE1 PHE A 59 9.706 -0.582 -5.954 1.00 0.00 C ATOM 893 CE2 PHE A 59 8.686 1.120 -4.556 1.00 0.00 C ATOM 894 CZ PHE A 59 9.144 -0.196 -4.730 1.00 0.00 C ATOM 0 H PHE A 59 8.260 4.069 -9.659 1.00 0.00 H new ATOM 0 HA PHE A 59 8.998 1.368 -9.780 1.00 0.00 H new ATOM 0 HB2 PHE A 59 10.289 2.739 -8.406 1.00 0.00 H new ATOM 0 HB3 PHE A 59 8.899 3.553 -7.715 1.00 0.00 H new ATOM 0 HD1 PHE A 59 10.280 0.056 -7.929 1.00 0.00 H new ATOM 0 HD2 PHE A 59 8.396 3.060 -5.471 1.00 0.00 H new ATOM 0 HE1 PHE A 59 10.052 -1.595 -6.094 1.00 0.00 H new ATOM 0 HE2 PHE A 59 8.268 1.419 -3.606 1.00 0.00 H new ATOM 0 HZ PHE A 59 9.063 -0.909 -3.923 1.00 0.00 H new ATOM 904 N VAL A 60 6.360 1.754 -7.790 1.00 0.00 N ATOM 905 CA VAL A 60 5.328 0.924 -7.142 1.00 0.00 C ATOM 906 C VAL A 60 4.321 0.303 -8.129 1.00 0.00 C ATOM 907 O VAL A 60 3.663 -0.673 -7.776 1.00 0.00 O ATOM 908 CB VAL A 60 4.579 1.737 -6.072 1.00 0.00 C ATOM 909 CG1 VAL A 60 5.384 2.008 -4.786 1.00 0.00 C ATOM 910 CG2 VAL A 60 4.136 3.066 -6.635 1.00 0.00 C ATOM 0 H VAL A 60 6.361 2.734 -7.506 1.00 0.00 H new ATOM 0 HA VAL A 60 5.860 0.093 -6.678 1.00 0.00 H new ATOM 0 HB VAL A 60 3.731 1.112 -5.795 1.00 0.00 H new ATOM 0 HG11 VAL A 60 4.776 2.587 -4.091 1.00 0.00 H new ATOM 0 HG12 VAL A 60 5.661 1.061 -4.324 1.00 0.00 H new ATOM 0 HG13 VAL A 60 6.286 2.569 -5.032 1.00 0.00 H new ATOM 0 HG21 VAL A 60 3.608 3.629 -5.866 1.00 0.00 H new ATOM 0 HG22 VAL A 60 5.008 3.631 -6.964 1.00 0.00 H new ATOM 0 HG23 VAL A 60 3.472 2.899 -7.483 1.00 0.00 H new ATOM 920 N LYS A 61 4.185 0.810 -9.358 1.00 0.00 N ATOM 921 CA LYS A 61 3.389 0.145 -10.388 1.00 0.00 C ATOM 922 C LYS A 61 4.038 -1.164 -10.851 1.00 0.00 C ATOM 923 O LYS A 61 3.317 -2.060 -11.278 1.00 0.00 O ATOM 924 CB LYS A 61 3.154 1.090 -11.575 1.00 0.00 C ATOM 925 CG LYS A 61 2.199 2.269 -11.284 1.00 0.00 C ATOM 926 CD LYS A 61 2.371 3.429 -12.274 1.00 0.00 C ATOM 927 CE LYS A 61 1.956 3.064 -13.703 1.00 0.00 C ATOM 928 NZ LYS A 61 3.015 2.353 -14.447 1.00 0.00 N ATOM 0 H LYS A 61 4.618 1.682 -9.662 1.00 0.00 H new ATOM 0 HA LYS A 61 2.425 -0.111 -9.949 1.00 0.00 H new ATOM 0 HB2 LYS A 61 4.115 1.490 -11.899 1.00 0.00 H new ATOM 0 HB3 LYS A 61 2.753 0.512 -12.408 1.00 0.00 H new ATOM 0 HG2 LYS A 61 1.169 1.915 -11.321 1.00 0.00 H new ATOM 0 HG3 LYS A 61 2.375 2.632 -10.271 1.00 0.00 H new ATOM 0 HD2 LYS A 61 1.778 4.279 -11.936 1.00 0.00 H new ATOM 0 HD3 LYS A 61 3.414 3.747 -12.275 1.00 0.00 H new ATOM 0 HE2 LYS A 61 1.063 2.440 -13.668 1.00 0.00 H new ATOM 0 HE3 LYS A 61 1.689 3.973 -14.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 3.006 2.659 -15.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 3.941 2.570 -14.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 2.845 1.328 -14.399 1.00 0.00 H new ATOM 942 N GLU A 62 5.360 -1.318 -10.758 1.00 0.00 N ATOM 943 CA GLU A 62 6.005 -2.601 -11.018 1.00 0.00 C ATOM 944 C GLU A 62 5.687 -3.616 -9.908 1.00 0.00 C ATOM 945 O GLU A 62 5.707 -4.827 -10.141 1.00 0.00 O ATOM 946 CB GLU A 62 7.520 -2.425 -11.270 1.00 0.00 C ATOM 947 CG GLU A 62 8.432 -2.285 -10.037 1.00 0.00 C ATOM 948 CD GLU A 62 9.666 -3.175 -10.063 1.00 0.00 C ATOM 949 OE1 GLU A 62 9.574 -4.396 -10.339 1.00 0.00 O ATOM 950 OE2 GLU A 62 10.770 -2.667 -9.773 1.00 0.00 O ATOM 0 H GLU A 62 6.003 -0.568 -10.504 1.00 0.00 H new ATOM 0 HA GLU A 62 5.592 -3.016 -11.937 1.00 0.00 H new ATOM 0 HB2 GLU A 62 7.867 -3.280 -11.850 1.00 0.00 H new ATOM 0 HB3 GLU A 62 7.657 -1.541 -11.893 1.00 0.00 H new ATOM 0 HG2 GLU A 62 8.750 -1.246 -9.952 1.00 0.00 H new ATOM 0 HG3 GLU A 62 7.852 -2.515 -9.143 1.00 0.00 H new ATOM 957 N LYS A 63 5.332 -3.152 -8.702 1.00 0.00 N ATOM 958 CA LYS A 63 5.050 -3.999 -7.545 1.00 0.00 C ATOM 959 C LYS A 63 3.597 -4.484 -7.548 1.00 0.00 C ATOM 960 O LYS A 63 2.989 -4.567 -6.488 1.00 0.00 O ATOM 961 CB LYS A 63 5.398 -3.257 -6.236 1.00 0.00 C ATOM 962 CG LYS A 63 6.854 -2.778 -6.127 1.00 0.00 C ATOM 963 CD LYS A 63 7.886 -3.917 -6.053 1.00 0.00 C ATOM 964 CE LYS A 63 8.206 -4.303 -4.598 1.00 0.00 C ATOM 965 NZ LYS A 63 9.106 -5.475 -4.480 1.00 0.00 N ATOM 0 H LYS A 63 5.232 -2.156 -8.504 1.00 0.00 H new ATOM 0 HA LYS A 63 5.682 -4.885 -7.609 1.00 0.00 H new ATOM 0 HB2 LYS A 63 4.739 -2.394 -6.140 1.00 0.00 H new ATOM 0 HB3 LYS A 63 5.185 -3.916 -5.395 1.00 0.00 H new ATOM 0 HG2 LYS A 63 7.084 -2.149 -6.987 1.00 0.00 H new ATOM 0 HG3 LYS A 63 6.954 -2.153 -5.240 1.00 0.00 H new ATOM 0 HD2 LYS A 63 7.505 -4.789 -6.585 1.00 0.00 H new ATOM 0 HD3 LYS A 63 8.802 -3.611 -6.558 1.00 0.00 H new ATOM 0 HE2 LYS A 63 8.665 -3.451 -4.097 1.00 0.00 H new ATOM 0 HE3 LYS A 63 7.274 -4.516 -4.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 9.831 -5.285 -3.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 8.553 -6.311 -4.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 9.567 -5.652 -5.395 1.00 0.00 H new ATOM 979 N GLY A 64 3.059 -4.822 -8.727 1.00 0.00 N ATOM 980 CA GLY A 64 1.843 -5.616 -8.946 1.00 0.00 C ATOM 981 C GLY A 64 0.623 -5.207 -8.112 1.00 0.00 C ATOM 982 O GLY A 64 -0.188 -6.065 -7.750 1.00 0.00 O ATOM 0 H GLY A 64 3.487 -4.531 -9.606 1.00 0.00 H new ATOM 0 HA2 GLY A 64 1.576 -5.554 -10.001 1.00 0.00 H new ATOM 0 HA3 GLY A 64 2.071 -6.661 -8.735 1.00 0.00 H new ATOM 986 N ALA A 65 0.522 -3.930 -7.731 1.00 0.00 N ATOM 987 CA ALA A 65 -0.344 -3.547 -6.632 1.00 0.00 C ATOM 988 C ALA A 65 -1.820 -3.530 -7.013 1.00 0.00 C ATOM 989 O ALA A 65 -2.178 -3.568 -8.191 1.00 0.00 O ATOM 990 CB ALA A 65 0.116 -2.214 -6.057 1.00 0.00 C ATOM 0 H ALA A 65 1.026 -3.158 -8.167 1.00 0.00 H new ATOM 0 HA ALA A 65 -0.259 -4.311 -5.859 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -0.537 -1.929 -5.232 1.00 0.00 H new ATOM 0 HB2 ALA A 65 1.140 -2.308 -5.694 1.00 0.00 H new ATOM 0 HB3 ALA A 65 0.075 -1.449 -6.833 1.00 0.00 H new ATOM 996 N GLU A 66 -2.685 -3.425 -6.003 1.00 0.00 N ATOM 997 CA GLU A 66 -4.133 -3.404 -6.176 1.00 0.00 C ATOM 998 C GLU A 66 -4.797 -2.450 -5.185 1.00 0.00 C ATOM 999 O GLU A 66 -5.781 -1.815 -5.560 1.00 0.00 O ATOM 1000 CB GLU A 66 -4.693 -4.823 -6.045 1.00 0.00 C ATOM 1001 CG GLU A 66 -4.689 -5.568 -7.385 1.00 0.00 C ATOM 1002 CD GLU A 66 -5.542 -6.839 -7.371 1.00 0.00 C ATOM 1003 OE1 GLU A 66 -5.434 -7.670 -6.439 1.00 0.00 O ATOM 1004 OE2 GLU A 66 -6.340 -7.029 -8.313 1.00 0.00 O ATOM 0 H GLU A 66 -2.392 -3.351 -5.029 1.00 0.00 H new ATOM 0 HA GLU A 66 -4.358 -3.033 -7.176 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -4.102 -5.380 -5.319 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -5.711 -4.777 -5.659 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -5.055 -4.901 -8.165 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -3.663 -5.829 -7.645 1.00 0.00 H new ATOM 1011 N LEU A 67 -4.264 -2.299 -3.967 1.00 0.00 N ATOM 1012 CA LEU A 67 -4.765 -1.340 -2.988 1.00 0.00 C ATOM 1013 C LEU A 67 -3.606 -0.456 -2.523 1.00 0.00 C ATOM 1014 O LEU A 67 -2.451 -0.894 -2.481 1.00 0.00 O ATOM 1015 CB LEU A 67 -5.402 -2.080 -1.788 1.00 0.00 C ATOM 1016 CG LEU A 67 -6.249 -1.155 -0.886 1.00 0.00 C ATOM 1017 CD1 LEU A 67 -7.697 -1.079 -1.366 1.00 0.00 C ATOM 1018 CD2 LEU A 67 -6.193 -1.584 0.575 1.00 0.00 C ATOM 0 H LEU A 67 -3.468 -2.844 -3.635 1.00 0.00 H new ATOM 0 HA LEU A 67 -5.534 -0.717 -3.444 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -6.030 -2.889 -2.160 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -4.613 -2.537 -1.191 1.00 0.00 H new ATOM 0 HG LEU A 67 -5.813 -0.158 -0.959 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -8.264 -0.420 -0.709 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -7.723 -0.687 -2.383 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -8.139 -2.075 -1.349 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -6.801 -0.908 1.176 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -6.576 -2.600 0.671 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -5.161 -1.551 0.925 1.00 0.00 H new ATOM 1030 N VAL A 68 -3.910 0.768 -2.103 1.00 0.00 N ATOM 1031 CA VAL A 68 -3.030 1.586 -1.291 1.00 0.00 C ATOM 1032 C VAL A 68 -3.891 2.227 -0.203 1.00 0.00 C ATOM 1033 O VAL A 68 -5.003 2.677 -0.490 1.00 0.00 O ATOM 1034 CB VAL A 68 -2.320 2.649 -2.150 1.00 0.00 C ATOM 1035 CG1 VAL A 68 -1.092 3.186 -1.423 1.00 0.00 C ATOM 1036 CG2 VAL A 68 -1.821 2.131 -3.504 1.00 0.00 C ATOM 0 H VAL A 68 -4.795 1.224 -2.325 1.00 0.00 H new ATOM 0 HA VAL A 68 -2.243 0.981 -0.841 1.00 0.00 H new ATOM 0 HB VAL A 68 -3.078 3.414 -2.321 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -0.601 3.936 -2.043 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -1.397 3.638 -0.479 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -0.399 2.368 -1.226 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -1.333 2.941 -4.046 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -1.109 1.321 -3.344 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -2.665 1.762 -4.086 1.00 0.00 H new ATOM 1046 N ILE A 69 -3.378 2.297 1.024 1.00 0.00 N ATOM 1047 CA ILE A 69 -3.979 3.014 2.138 1.00 0.00 C ATOM 1048 C ILE A 69 -3.005 4.130 2.491 1.00 0.00 C ATOM 1049 O ILE A 69 -1.829 3.879 2.751 1.00 0.00 O ATOM 1050 CB ILE A 69 -4.241 2.061 3.312 1.00 0.00 C ATOM 1051 CG1 ILE A 69 -5.232 0.936 2.941 1.00 0.00 C ATOM 1052 CG2 ILE A 69 -4.772 2.793 4.549 1.00 0.00 C ATOM 1053 CD1 ILE A 69 -4.637 -0.413 3.345 1.00 0.00 C ATOM 0 H ILE A 69 -2.502 1.839 1.275 1.00 0.00 H new ATOM 0 HA ILE A 69 -4.952 3.434 1.883 1.00 0.00 H new ATOM 0 HB ILE A 69 -3.271 1.622 3.547 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -6.185 1.093 3.447 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -5.434 0.952 1.870 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -4.941 2.075 5.352 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -4.043 3.535 4.874 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -5.710 3.290 4.303 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -5.333 -1.210 3.085 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -3.695 -0.568 2.818 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -4.458 -0.424 4.420 1.00 0.00 H new ATOM 1065 N VAL A 70 -3.473 5.370 2.438 1.00 0.00 N ATOM 1066 CA VAL A 70 -2.662 6.567 2.553 1.00 0.00 C ATOM 1067 C VAL A 70 -3.313 7.543 3.526 1.00 0.00 C ATOM 1068 O VAL A 70 -4.510 7.470 3.819 1.00 0.00 O ATOM 1069 CB VAL A 70 -2.451 7.187 1.155 1.00 0.00 C ATOM 1070 CG1 VAL A 70 -1.601 6.293 0.242 1.00 0.00 C ATOM 1071 CG2 VAL A 70 -3.766 7.537 0.440 1.00 0.00 C ATOM 0 H VAL A 70 -4.464 5.573 2.309 1.00 0.00 H new ATOM 0 HA VAL A 70 -1.680 6.316 2.954 1.00 0.00 H new ATOM 0 HB VAL A 70 -1.913 8.116 1.345 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -1.482 6.773 -0.729 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -0.621 6.139 0.694 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -2.096 5.330 0.112 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -3.546 7.968 -0.536 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -4.362 6.633 0.311 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -4.324 8.258 1.037 1.00 0.00 H new ATOM 1081 N ARG A 71 -2.524 8.507 4.002 1.00 0.00 N ATOM 1082 CA ARG A 71 -3.023 9.556 4.871 1.00 0.00 C ATOM 1083 C ARG A 71 -3.444 10.726 3.990 1.00 0.00 C ATOM 1084 O ARG A 71 -4.643 10.903 3.772 1.00 0.00 O ATOM 1085 CB ARG A 71 -1.989 9.843 5.969 1.00 0.00 C ATOM 1086 CG ARG A 71 -2.536 10.708 7.114 1.00 0.00 C ATOM 1087 CD ARG A 71 -1.659 10.519 8.368 1.00 0.00 C ATOM 1088 NE ARG A 71 -1.972 11.423 9.492 1.00 0.00 N ATOM 1089 CZ ARG A 71 -1.971 12.762 9.546 1.00 0.00 C ATOM 1090 NH1 ARG A 71 -1.728 13.512 8.473 1.00 0.00 N ATOM 1091 NH2 ARG A 71 -2.160 13.365 10.715 1.00 0.00 N ATOM 0 H ARG A 71 -1.528 8.577 3.794 1.00 0.00 H new ATOM 0 HA ARG A 71 -3.917 9.277 5.428 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -1.632 8.897 6.377 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -1.129 10.344 5.525 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -2.545 11.757 6.819 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -3.567 10.430 7.333 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -1.760 9.489 8.711 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -0.615 10.661 8.087 1.00 0.00 H new ATOM 0 HE ARG A 71 -2.229 10.957 10.362 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -1.535 13.069 7.575 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -1.735 14.529 8.549 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -2.304 12.809 11.558 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -2.161 14.384 10.769 1.00 0.00 H new ATOM 1105 N GLY A 72 -2.505 11.502 3.445 1.00 0.00 N ATOM 1106 CA GLY A 72 -2.805 12.746 2.735 1.00 0.00 C ATOM 1107 C GLY A 72 -2.560 12.700 1.227 1.00 0.00 C ATOM 1108 O GLY A 72 -3.228 13.445 0.505 1.00 0.00 O ATOM 0 H GLY A 72 -1.509 11.283 3.484 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -3.849 13.005 2.911 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -2.201 13.546 3.163 1.00 0.00 H new ATOM 1112 N ILE A 73 -1.634 11.847 0.758 1.00 0.00 N ATOM 1113 CA ILE A 73 -1.231 11.647 -0.644 1.00 0.00 C ATOM 1114 C ILE A 73 -1.210 12.969 -1.452 1.00 0.00 C ATOM 1115 O ILE A 73 -0.768 13.988 -0.915 1.00 0.00 O ATOM 1116 CB ILE A 73 -2.051 10.447 -1.226 1.00 0.00 C ATOM 1117 CG1 ILE A 73 -1.559 9.966 -2.605 1.00 0.00 C ATOM 1118 CG2 ILE A 73 -3.580 10.663 -1.300 1.00 0.00 C ATOM 1119 CD1 ILE A 73 -1.699 8.462 -2.829 1.00 0.00 C ATOM 0 H ILE A 73 -1.113 11.239 1.390 1.00 0.00 H new ATOM 0 HA ILE A 73 -0.185 11.350 -0.723 1.00 0.00 H new ATOM 0 HB ILE A 73 -1.861 9.673 -0.482 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -2.116 10.491 -3.381 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -0.511 10.244 -2.722 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -4.053 9.774 -1.717 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -3.970 10.846 -0.299 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -3.796 11.521 -1.936 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -1.331 8.206 -3.822 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -1.118 7.927 -2.078 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -2.748 8.178 -2.747 1.00 0.00 H new ATOM 1131 N GLY A 74 -1.592 12.959 -2.734 1.00 0.00 N ATOM 1132 CA GLY A 74 -1.680 14.090 -3.648 1.00 0.00 C ATOM 1133 C GLY A 74 -2.246 13.631 -4.988 1.00 0.00 C ATOM 1134 O GLY A 74 -2.128 12.451 -5.327 1.00 0.00 O ATOM 0 H GLY A 74 -1.868 12.089 -3.189 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -2.316 14.865 -3.221 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -0.693 14.530 -3.792 1.00 0.00 H new ATOM 1138 N ARG A 75 -2.850 14.540 -5.765 1.00 0.00 N ATOM 1139 CA ARG A 75 -3.561 14.156 -6.991 1.00 0.00 C ATOM 1140 C ARG A 75 -2.628 13.531 -8.023 1.00 0.00 C ATOM 1141 O ARG A 75 -3.008 12.582 -8.705 1.00 0.00 O ATOM 1142 CB ARG A 75 -4.322 15.349 -7.597 1.00 0.00 C ATOM 1143 CG ARG A 75 -5.818 15.060 -7.767 1.00 0.00 C ATOM 1144 CD ARG A 75 -6.168 13.960 -8.778 1.00 0.00 C ATOM 1145 NE ARG A 75 -5.979 14.376 -10.177 1.00 0.00 N ATOM 1146 CZ ARG A 75 -6.233 13.593 -11.235 1.00 0.00 C ATOM 1147 NH1 ARG A 75 -6.670 12.348 -11.071 1.00 0.00 N ATOM 1148 NH2 ARG A 75 -6.047 14.061 -12.457 1.00 0.00 N ATOM 0 H ARG A 75 -2.861 15.541 -5.568 1.00 0.00 H new ATOM 0 HA ARG A 75 -4.290 13.397 -6.706 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -4.193 16.222 -6.957 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -3.890 15.598 -8.566 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -6.229 14.781 -6.797 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -6.316 15.981 -8.071 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -5.551 13.084 -8.580 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -7.205 13.659 -8.632 1.00 0.00 H new ATOM 0 HE ARG A 75 -5.633 15.319 -10.353 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -6.816 11.978 -10.132 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -6.859 11.763 -11.885 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -5.711 15.015 -12.592 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -6.239 13.468 -13.265 1.00 0.00 H new ATOM 1162 N ARG A 76 -1.391 14.023 -8.113 1.00 0.00 N ATOM 1163 CA ARG A 76 -0.363 13.461 -8.983 1.00 0.00 C ATOM 1164 C ARG A 76 -0.155 11.971 -8.715 1.00 0.00 C ATOM 1165 O ARG A 76 0.182 11.245 -9.652 1.00 0.00 O ATOM 1166 CB ARG A 76 0.942 14.259 -8.800 1.00 0.00 C ATOM 1167 CG ARG A 76 2.081 13.744 -9.692 1.00 0.00 C ATOM 1168 CD ARG A 76 3.336 14.619 -9.579 1.00 0.00 C ATOM 1169 NE ARG A 76 3.902 14.990 -10.884 1.00 0.00 N ATOM 1170 CZ ARG A 76 3.476 15.954 -11.706 1.00 0.00 C ATOM 1171 NH1 ARG A 76 2.305 16.556 -11.504 1.00 0.00 N ATOM 1172 NH2 ARG A 76 4.222 16.325 -12.733 1.00 0.00 N ATOM 0 H ARG A 76 -1.074 14.831 -7.577 1.00 0.00 H new ATOM 0 HA ARG A 76 -0.688 13.545 -10.020 1.00 0.00 H new ATOM 0 HB2 ARG A 76 0.756 15.309 -9.025 1.00 0.00 H new ATOM 0 HB3 ARG A 76 1.252 14.207 -7.756 1.00 0.00 H new ATOM 0 HG2 ARG A 76 2.326 12.719 -9.412 1.00 0.00 H new ATOM 0 HG3 ARG A 76 1.747 13.720 -10.729 1.00 0.00 H new ATOM 0 HD2 ARG A 76 3.091 15.525 -9.026 1.00 0.00 H new ATOM 0 HD3 ARG A 76 4.091 14.087 -9.001 1.00 0.00 H new ATOM 0 HE ARG A 76 4.710 14.452 -11.197 1.00 0.00 H new ATOM 0 HH11 ARG A 76 1.721 16.283 -10.714 1.00 0.00 H new ATOM 0 HH12 ARG A 76 1.993 17.290 -12.140 1.00 0.00 H new ATOM 0 HH21 ARG A 76 5.123 15.875 -12.898 1.00 0.00 H new ATOM 0 HH22 ARG A 76 3.897 17.061 -13.360 1.00 0.00 H new ATOM 1186 N ALA A 77 -0.317 11.527 -7.466 1.00 0.00 N ATOM 1187 CA ALA A 77 -0.158 10.133 -7.094 1.00 0.00 C ATOM 1188 C ALA A 77 -1.444 9.350 -7.329 1.00 0.00 C ATOM 1189 O ALA A 77 -1.339 8.259 -7.884 1.00 0.00 O ATOM 1190 CB ALA A 77 0.288 10.042 -5.640 1.00 0.00 C ATOM 0 H ALA A 77 -0.564 12.135 -6.685 1.00 0.00 H new ATOM 0 HA ALA A 77 0.609 9.684 -7.725 1.00 0.00 H new ATOM 0 HB1 ALA A 77 0.407 8.995 -5.361 1.00 0.00 H new ATOM 0 HB2 ALA A 77 1.239 10.561 -5.518 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -0.463 10.505 -5.000 1.00 0.00 H new ATOM 1196 N ILE A 78 -2.629 9.910 -7.021 1.00 0.00 N ATOM 1197 CA ILE A 78 -3.898 9.352 -7.469 1.00 0.00 C ATOM 1198 C ILE A 78 -3.778 8.972 -8.955 1.00 0.00 C ATOM 1199 O ILE A 78 -4.102 7.857 -9.334 1.00 0.00 O ATOM 1200 CB ILE A 78 -5.026 10.363 -7.154 1.00 0.00 C ATOM 1201 CG1 ILE A 78 -5.693 10.139 -5.785 1.00 0.00 C ATOM 1202 CG2 ILE A 78 -6.158 10.421 -8.197 1.00 0.00 C ATOM 1203 CD1 ILE A 78 -4.805 9.951 -4.556 1.00 0.00 C ATOM 0 H ILE A 78 -2.723 10.756 -6.458 1.00 0.00 H new ATOM 0 HA ILE A 78 -4.154 8.434 -6.940 1.00 0.00 H new ATOM 0 HB ILE A 78 -4.481 11.307 -7.165 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -6.346 10.990 -5.593 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -6.331 9.259 -5.869 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -6.900 11.157 -7.888 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -5.746 10.705 -9.165 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -6.630 9.442 -8.276 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -5.430 9.805 -3.675 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -4.168 9.078 -4.698 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -4.183 10.836 -4.418 1.00 0.00 H new ATOM 1215 N ALA A 79 -3.238 9.836 -9.817 1.00 0.00 N ATOM 1216 CA ALA A 79 -3.185 9.545 -11.246 1.00 0.00 C ATOM 1217 C ALA A 79 -2.357 8.290 -11.628 1.00 0.00 C ATOM 1218 O ALA A 79 -2.445 7.858 -12.785 1.00 0.00 O ATOM 1219 CB ALA A 79 -2.709 10.784 -11.994 1.00 0.00 C ATOM 0 H ALA A 79 -2.835 10.735 -9.551 1.00 0.00 H new ATOM 0 HA ALA A 79 -4.200 9.290 -11.549 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -2.668 10.571 -13.062 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -3.402 11.606 -11.814 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -1.716 11.063 -11.641 1.00 0.00 H new ATOM 1225 N ALA A 80 -1.566 7.700 -10.715 1.00 0.00 N ATOM 1226 CA ALA A 80 -0.864 6.434 -10.909 1.00 0.00 C ATOM 1227 C ALA A 80 -1.657 5.215 -10.421 1.00 0.00 C ATOM 1228 O ALA A 80 -1.556 4.141 -11.011 1.00 0.00 O ATOM 1229 CB ALA A 80 0.448 6.499 -10.148 1.00 0.00 C ATOM 0 H ALA A 80 -1.397 8.109 -9.796 1.00 0.00 H new ATOM 0 HA ALA A 80 -0.714 6.305 -11.981 1.00 0.00 H new ATOM 0 HB1 ALA A 80 0.991 5.563 -10.278 1.00 0.00 H new ATOM 0 HB2 ALA A 80 1.050 7.324 -10.530 1.00 0.00 H new ATOM 0 HB3 ALA A 80 0.247 6.657 -9.089 1.00 0.00 H new ATOM 1235 N PHE A 81 -2.462 5.340 -9.367 1.00 0.00 N ATOM 1236 CA PHE A 81 -3.623 4.496 -9.122 1.00 0.00 C ATOM 1237 C PHE A 81 -4.415 4.379 -10.381 1.00 0.00 C ATOM 1238 O PHE A 81 -4.659 3.281 -10.859 1.00 0.00 O ATOM 1239 CB PHE A 81 -4.514 5.098 -8.035 1.00 0.00 C ATOM 1240 CG PHE A 81 -6.025 5.296 -8.259 1.00 0.00 C ATOM 1241 CD1 PHE A 81 -6.879 4.241 -8.628 1.00 0.00 C ATOM 1242 CD2 PHE A 81 -6.602 6.562 -8.054 1.00 0.00 C ATOM 1243 CE1 PHE A 81 -8.264 4.424 -8.756 1.00 0.00 C ATOM 1244 CE2 PHE A 81 -7.987 6.758 -8.176 1.00 0.00 C ATOM 1245 CZ PHE A 81 -8.825 5.690 -8.524 1.00 0.00 C ATOM 0 H PHE A 81 -2.319 6.047 -8.646 1.00 0.00 H new ATOM 0 HA PHE A 81 -3.277 3.516 -8.792 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -4.403 4.472 -7.150 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -4.098 6.075 -7.788 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -6.458 3.265 -8.818 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -5.968 7.398 -7.798 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -8.897 3.594 -9.032 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -8.409 7.737 -8.001 1.00 0.00 H new ATOM 0 HZ PHE A 81 -9.891 5.839 -8.613 1.00 0.00 H new ATOM 1255 N GLU A 82 -4.796 5.529 -10.910 1.00 0.00 N ATOM 1256 CA GLU A 82 -5.644 5.638 -12.062 1.00 0.00 C ATOM 1257 C GLU A 82 -4.900 5.173 -13.314 1.00 0.00 C ATOM 1258 O GLU A 82 -5.475 5.231 -14.403 1.00 0.00 O ATOM 1259 CB GLU A 82 -6.041 7.101 -12.266 1.00 0.00 C ATOM 1260 CG GLU A 82 -6.850 7.795 -11.152 1.00 0.00 C ATOM 1261 CD GLU A 82 -7.315 9.207 -11.545 1.00 0.00 C ATOM 1262 OE1 GLU A 82 -6.630 9.892 -12.348 1.00 0.00 O ATOM 1263 OE2 GLU A 82 -8.295 9.710 -10.948 1.00 0.00 O ATOM 0 H GLU A 82 -4.510 6.432 -10.532 1.00 0.00 H new ATOM 0 HA GLU A 82 -6.525 5.017 -11.901 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -5.128 7.676 -12.423 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -6.620 7.164 -13.187 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -7.720 7.186 -10.908 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -6.240 7.856 -10.251 1.00 0.00 H new ATOM 1270 N ALA A 83 -3.614 4.807 -13.220 1.00 0.00 N ATOM 1271 CA ALA A 83 -2.940 4.164 -14.322 1.00 0.00 C ATOM 1272 C ALA A 83 -3.108 2.649 -14.252 1.00 0.00 C ATOM 1273 O ALA A 83 -2.718 1.978 -15.207 1.00 0.00 O ATOM 1274 CB ALA A 83 -1.452 4.537 -14.333 1.00 0.00 C ATOM 0 H ALA A 83 -3.036 4.950 -12.392 1.00 0.00 H new ATOM 0 HA ALA A 83 -3.394 4.515 -15.249 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -0.959 4.043 -15.171 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -1.348 5.617 -14.437 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -0.990 4.216 -13.400 1.00 0.00 H new ATOM 1280 N MET A 84 -3.632 2.101 -13.147 1.00 0.00 N ATOM 1281 CA MET A 84 -3.865 0.657 -13.044 1.00 0.00 C ATOM 1282 C MET A 84 -5.197 0.273 -12.387 1.00 0.00 C ATOM 1283 O MET A 84 -5.440 -0.914 -12.161 1.00 0.00 O ATOM 1284 CB MET A 84 -2.642 -0.044 -12.421 1.00 0.00 C ATOM 1285 CG MET A 84 -1.773 0.780 -11.466 1.00 0.00 C ATOM 1286 SD MET A 84 -0.439 -0.160 -10.653 1.00 0.00 S ATOM 1287 CE MET A 84 0.168 -1.261 -11.961 1.00 0.00 C ATOM 0 H MET A 84 -3.900 2.632 -12.319 1.00 0.00 H new ATOM 0 HA MET A 84 -3.977 0.284 -14.062 1.00 0.00 H new ATOM 0 HB2 MET A 84 -2.995 -0.924 -11.882 1.00 0.00 H new ATOM 0 HB3 MET A 84 -2.007 -0.400 -13.232 1.00 0.00 H new ATOM 0 HG2 MET A 84 -1.331 1.608 -12.021 1.00 0.00 H new ATOM 0 HG3 MET A 84 -2.412 1.216 -10.698 1.00 0.00 H new ATOM 0 HE1 MET A 84 0.980 -1.875 -11.572 1.00 0.00 H new ATOM 0 HE2 MET A 84 -0.644 -1.905 -12.301 1.00 0.00 H new ATOM 0 HE3 MET A 84 0.533 -0.665 -12.798 1.00 0.00 H new ATOM 1297 N GLY A 85 -6.064 1.238 -12.078 1.00 0.00 N ATOM 1298 CA GLY A 85 -7.236 1.011 -11.235 1.00 0.00 C ATOM 1299 C GLY A 85 -6.842 0.545 -9.825 1.00 0.00 C ATOM 1300 O GLY A 85 -7.529 -0.278 -9.224 1.00 0.00 O ATOM 0 H GLY A 85 -5.972 2.199 -12.406 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -7.817 1.931 -11.165 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -7.878 0.263 -11.699 1.00 0.00 H new ATOM 1304 N VAL A 86 -5.711 1.017 -9.297 1.00 0.00 N ATOM 1305 CA VAL A 86 -5.194 0.652 -7.971 1.00 0.00 C ATOM 1306 C VAL A 86 -5.910 1.450 -6.874 1.00 0.00 C ATOM 1307 O VAL A 86 -5.547 2.589 -6.603 1.00 0.00 O ATOM 1308 CB VAL A 86 -3.654 0.787 -7.985 1.00 0.00 C ATOM 1309 CG1 VAL A 86 -2.981 0.958 -6.626 1.00 0.00 C ATOM 1310 CG2 VAL A 86 -3.103 -0.497 -8.595 1.00 0.00 C ATOM 0 H VAL A 86 -5.113 1.680 -9.789 1.00 0.00 H new ATOM 0 HA VAL A 86 -5.410 -0.389 -7.732 1.00 0.00 H new ATOM 0 HB VAL A 86 -3.438 1.699 -8.542 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -1.903 1.042 -6.762 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -3.358 1.860 -6.144 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -3.201 0.094 -6.000 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -2.015 -0.447 -8.626 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -3.410 -1.349 -7.989 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -3.490 -0.614 -9.607 1.00 0.00 H new ATOM 1320 N LYS A 87 -6.933 0.864 -6.248 1.00 0.00 N ATOM 1321 CA LYS A 87 -7.868 1.524 -5.336 1.00 0.00 C ATOM 1322 C LYS A 87 -7.142 2.334 -4.261 1.00 0.00 C ATOM 1323 O LYS A 87 -6.078 1.908 -3.788 1.00 0.00 O ATOM 1324 CB LYS A 87 -8.747 0.445 -4.710 1.00 0.00 C ATOM 1325 CG LYS A 87 -10.020 1.002 -4.056 1.00 0.00 C ATOM 1326 CD LYS A 87 -10.527 0.057 -2.959 1.00 0.00 C ATOM 1327 CE LYS A 87 -12.031 -0.218 -2.986 1.00 0.00 C ATOM 1328 NZ LYS A 87 -12.430 -0.954 -4.197 1.00 0.00 N ATOM 0 H LYS A 87 -7.141 -0.127 -6.369 1.00 0.00 H new ATOM 0 HA LYS A 87 -8.478 2.237 -5.892 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -9.027 -0.276 -5.478 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -8.169 -0.095 -3.961 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -9.816 1.984 -3.630 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -10.793 1.137 -4.812 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -9.998 -0.892 -3.045 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -10.268 0.480 -1.988 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -12.312 -0.792 -2.103 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -12.574 0.726 -2.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -13.399 -1.313 -4.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -12.392 -0.317 -5.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -11.781 -1.753 -4.348 1.00 0.00 H new ATOM 1342 N VAL A 88 -7.715 3.465 -3.838 1.00 0.00 N ATOM 1343 CA VAL A 88 -7.031 4.397 -2.953 1.00 0.00 C ATOM 1344 C VAL A 88 -7.861 4.691 -1.713 1.00 0.00 C ATOM 1345 O VAL A 88 -8.834 5.438 -1.764 1.00 0.00 O ATOM 1346 CB VAL A 88 -6.647 5.720 -3.653 1.00 0.00 C ATOM 1347 CG1 VAL A 88 -5.377 6.249 -2.971 1.00 0.00 C ATOM 1348 CG2 VAL A 88 -6.507 5.669 -5.172 1.00 0.00 C ATOM 0 H VAL A 88 -8.658 3.753 -4.100 1.00 0.00 H new ATOM 0 HA VAL A 88 -6.106 3.903 -2.657 1.00 0.00 H new ATOM 0 HB VAL A 88 -7.487 6.403 -3.530 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -5.075 7.185 -3.440 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -5.577 6.421 -1.913 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -4.576 5.517 -3.074 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -6.235 6.656 -5.546 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -5.731 4.953 -5.442 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -7.454 5.362 -5.615 1.00 0.00 H new ATOM 1358 N ILE A 89 -7.443 4.160 -0.573 1.00 0.00 N ATOM 1359 CA ILE A 89 -8.072 4.427 0.706 1.00 0.00 C ATOM 1360 C ILE A 89 -7.329 5.595 1.342 1.00 0.00 C ATOM 1361 O ILE A 89 -6.231 5.426 1.865 1.00 0.00 O ATOM 1362 CB ILE A 89 -8.106 3.120 1.519 1.00 0.00 C ATOM 1363 CG1 ILE A 89 -9.036 2.145 0.761 1.00 0.00 C ATOM 1364 CG2 ILE A 89 -8.567 3.347 2.961 1.00 0.00 C ATOM 1365 CD1 ILE A 89 -9.364 0.849 1.488 1.00 0.00 C ATOM 0 H ILE A 89 -6.648 3.524 -0.513 1.00 0.00 H new ATOM 0 HA ILE A 89 -9.115 4.736 0.632 1.00 0.00 H new ATOM 0 HB ILE A 89 -7.103 2.702 1.606 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -9.970 2.661 0.538 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -8.572 1.897 -0.194 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -8.575 2.396 3.494 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -7.884 4.036 3.457 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -9.571 3.770 2.960 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -10.022 0.240 0.868 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -8.443 0.301 1.688 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -9.862 1.077 2.430 1.00 0.00 H new ATOM 1377 N LYS A 90 -7.883 6.804 1.235 1.00 0.00 N ATOM 1378 CA LYS A 90 -7.316 7.977 1.898 1.00 0.00 C ATOM 1379 C LYS A 90 -7.796 8.045 3.347 1.00 0.00 C ATOM 1380 O LYS A 90 -8.794 7.416 3.722 1.00 0.00 O ATOM 1381 CB LYS A 90 -7.705 9.252 1.123 1.00 0.00 C ATOM 1382 CG LYS A 90 -6.925 9.450 -0.195 1.00 0.00 C ATOM 1383 CD LYS A 90 -7.808 9.701 -1.429 1.00 0.00 C ATOM 1384 CE LYS A 90 -8.467 8.376 -1.809 1.00 0.00 C ATOM 1385 NZ LYS A 90 -9.332 8.421 -3.006 1.00 0.00 N ATOM 0 H LYS A 90 -8.726 6.995 0.694 1.00 0.00 H new ATOM 0 HA LYS A 90 -6.229 7.898 1.907 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -8.771 9.218 0.900 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -7.541 10.118 1.764 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -6.243 10.292 -0.075 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -6.313 8.567 -0.376 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -8.564 10.455 -1.211 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -7.209 10.081 -2.257 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -7.685 7.634 -1.974 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -9.062 8.030 -0.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -9.732 7.477 -3.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -10.104 9.100 -2.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -8.770 8.717 -3.829 1.00 0.00 H new ATOM 1399 N GLY A 91 -7.134 8.885 4.141 1.00 0.00 N ATOM 1400 CA GLY A 91 -7.626 9.289 5.446 1.00 0.00 C ATOM 1401 C GLY A 91 -7.339 8.287 6.554 1.00 0.00 C ATOM 1402 O GLY A 91 -8.018 8.335 7.581 1.00 0.00 O ATOM 0 H GLY A 91 -6.238 9.303 3.891 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -7.178 10.246 5.711 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -8.703 9.448 5.384 1.00 0.00 H new ATOM 1406 N ALA A 92 -6.400 7.362 6.351 1.00 0.00 N ATOM 1407 CA ALA A 92 -5.978 6.445 7.398 1.00 0.00 C ATOM 1408 C ALA A 92 -4.947 7.120 8.304 1.00 0.00 C ATOM 1409 O ALA A 92 -4.346 8.133 7.935 1.00 0.00 O ATOM 1410 CB ALA A 92 -5.386 5.202 6.740 1.00 0.00 C ATOM 0 H ALA A 92 -5.917 7.232 5.462 1.00 0.00 H new ATOM 0 HA ALA A 92 -6.830 6.161 8.015 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -5.063 4.501 7.510 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -6.141 4.729 6.112 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -4.531 5.487 6.127 1.00 0.00 H new ATOM 1416 N SER A 93 -4.679 6.509 9.453 1.00 0.00 N ATOM 1417 CA SER A 93 -3.598 6.839 10.357 1.00 0.00 C ATOM 1418 C SER A 93 -3.240 5.550 11.116 1.00 0.00 C ATOM 1419 O SER A 93 -4.068 4.638 11.174 1.00 0.00 O ATOM 1420 CB SER A 93 -3.961 8.037 11.250 1.00 0.00 C ATOM 1421 OG SER A 93 -5.266 8.023 11.796 1.00 0.00 O ATOM 0 H SER A 93 -5.244 5.730 9.791 1.00 0.00 H new ATOM 0 HA SER A 93 -2.710 7.179 9.825 1.00 0.00 H new ATOM 0 HB2 SER A 93 -3.245 8.085 12.070 1.00 0.00 H new ATOM 0 HB3 SER A 93 -3.841 8.950 10.667 1.00 0.00 H new ATOM 0 HG SER A 93 -5.399 8.822 12.347 1.00 0.00 H new ATOM 1427 N GLY A 94 -2.034 5.473 11.677 1.00 0.00 N ATOM 1428 CA GLY A 94 -1.603 4.392 12.558 1.00 0.00 C ATOM 1429 C GLY A 94 -0.440 3.585 11.990 1.00 0.00 C ATOM 1430 O GLY A 94 0.117 3.895 10.930 1.00 0.00 O ATOM 0 H GLY A 94 -1.313 6.179 11.527 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -1.311 4.811 13.521 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -2.445 3.724 12.743 1.00 0.00 H new ATOM 1434 N THR A 95 -0.053 2.527 12.698 1.00 0.00 N ATOM 1435 CA THR A 95 0.981 1.606 12.256 1.00 0.00 C ATOM 1436 C THR A 95 0.382 0.635 11.240 1.00 0.00 C ATOM 1437 O THR A 95 -0.840 0.490 11.203 1.00 0.00 O ATOM 1438 CB THR A 95 1.550 0.850 13.463 1.00 0.00 C ATOM 1439 OG1 THR A 95 0.540 0.183 14.192 1.00 0.00 O ATOM 1440 CG2 THR A 95 2.235 1.814 14.434 1.00 0.00 C ATOM 0 H THR A 95 -0.455 2.286 13.604 1.00 0.00 H new ATOM 0 HA THR A 95 1.795 2.156 11.783 1.00 0.00 H new ATOM 0 HB THR A 95 2.259 0.127 13.059 1.00 0.00 H new ATOM 0 HG1 THR A 95 0.942 -0.288 14.952 1.00 0.00 H new ATOM 0 HG21 THR A 95 2.631 1.256 15.282 1.00 0.00 H new ATOM 0 HG22 THR A 95 3.051 2.326 13.924 1.00 0.00 H new ATOM 0 HG23 THR A 95 1.512 2.548 14.789 1.00 0.00 H new ATOM 1448 N VAL A 96 1.208 -0.029 10.423 1.00 0.00 N ATOM 1449 CA VAL A 96 0.706 -0.834 9.307 1.00 0.00 C ATOM 1450 C VAL A 96 -0.237 -1.898 9.849 1.00 0.00 C ATOM 1451 O VAL A 96 -1.322 -2.072 9.304 1.00 0.00 O ATOM 1452 CB VAL A 96 1.883 -1.457 8.529 1.00 0.00 C ATOM 1453 CG1 VAL A 96 1.502 -2.659 7.654 1.00 0.00 C ATOM 1454 CG2 VAL A 96 2.524 -0.405 7.634 1.00 0.00 C ATOM 0 H VAL A 96 2.224 -0.024 10.514 1.00 0.00 H new ATOM 0 HA VAL A 96 0.153 -0.205 8.609 1.00 0.00 H new ATOM 0 HB VAL A 96 2.572 -1.821 9.291 1.00 0.00 H new ATOM 0 HG11 VAL A 96 2.389 -3.033 7.144 1.00 0.00 H new ATOM 0 HG12 VAL A 96 1.084 -3.447 8.280 1.00 0.00 H new ATOM 0 HG13 VAL A 96 0.762 -2.351 6.916 1.00 0.00 H new ATOM 0 HG21 VAL A 96 3.355 -0.850 7.087 1.00 0.00 H new ATOM 0 HG22 VAL A 96 1.784 -0.029 6.927 1.00 0.00 H new ATOM 0 HG23 VAL A 96 2.892 0.418 8.246 1.00 0.00 H new ATOM 1464 N GLU A 97 0.159 -2.598 10.915 1.00 0.00 N ATOM 1465 CA GLU A 97 -0.654 -3.693 11.444 1.00 0.00 C ATOM 1466 C GLU A 97 -2.049 -3.229 11.904 1.00 0.00 C ATOM 1467 O GLU A 97 -2.984 -4.029 11.923 1.00 0.00 O ATOM 1468 CB GLU A 97 0.062 -4.432 12.568 1.00 0.00 C ATOM 1469 CG GLU A 97 0.386 -3.508 13.740 1.00 0.00 C ATOM 1470 CD GLU A 97 0.053 -4.168 15.069 1.00 0.00 C ATOM 1471 OE1 GLU A 97 0.867 -4.976 15.575 1.00 0.00 O ATOM 1472 OE2 GLU A 97 -1.068 -3.952 15.582 1.00 0.00 O ATOM 0 H GLU A 97 1.027 -2.428 11.423 1.00 0.00 H new ATOM 0 HA GLU A 97 -0.801 -4.386 10.616 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -0.562 -5.255 12.916 1.00 0.00 H new ATOM 0 HB3 GLU A 97 0.984 -4.870 12.185 1.00 0.00 H new ATOM 0 HG2 GLU A 97 1.443 -3.244 13.717 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -0.177 -2.580 13.641 1.00 0.00 H new ATOM 1479 N GLU A 98 -2.182 -1.962 12.307 1.00 0.00 N ATOM 1480 CA GLU A 98 -3.431 -1.350 12.734 1.00 0.00 C ATOM 1481 C GLU A 98 -4.220 -1.017 11.478 1.00 0.00 C ATOM 1482 O GLU A 98 -5.296 -1.571 11.281 1.00 0.00 O ATOM 1483 CB GLU A 98 -3.167 -0.104 13.597 1.00 0.00 C ATOM 1484 CG GLU A 98 -4.466 0.540 14.105 1.00 0.00 C ATOM 1485 CD GLU A 98 -4.198 1.896 14.756 1.00 0.00 C ATOM 1486 OE1 GLU A 98 -3.485 1.960 15.782 1.00 0.00 O ATOM 1487 OE2 GLU A 98 -4.664 2.935 14.239 1.00 0.00 O ATOM 0 H GLU A 98 -1.393 -1.317 12.344 1.00 0.00 H new ATOM 0 HA GLU A 98 -4.004 -2.033 13.361 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -2.544 -0.380 14.448 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -2.606 0.626 13.014 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -5.161 0.664 13.275 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -4.945 -0.123 14.825 1.00 0.00 H new ATOM 1494 N VAL A 99 -3.671 -0.160 10.608 1.00 0.00 N ATOM 1495 CA VAL A 99 -4.284 0.288 9.373 1.00 0.00 C ATOM 1496 C VAL A 99 -4.853 -0.916 8.622 1.00 0.00 C ATOM 1497 O VAL A 99 -6.045 -0.942 8.308 1.00 0.00 O ATOM 1498 CB VAL A 99 -3.194 1.058 8.584 1.00 0.00 C ATOM 1499 CG1 VAL A 99 -3.600 1.396 7.165 1.00 0.00 C ATOM 1500 CG2 VAL A 99 -2.843 2.406 9.224 1.00 0.00 C ATOM 0 H VAL A 99 -2.750 0.251 10.761 1.00 0.00 H new ATOM 0 HA VAL A 99 -5.127 0.959 9.539 1.00 0.00 H new ATOM 0 HB VAL A 99 -2.350 0.369 8.596 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -2.790 1.934 6.673 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -3.810 0.477 6.618 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -4.493 2.021 7.181 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -2.075 2.902 8.630 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -3.733 3.033 9.262 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -2.471 2.243 10.235 1.00 0.00 H new ATOM 1510 N VAL A 100 -4.016 -1.912 8.337 1.00 0.00 N ATOM 1511 CA VAL A 100 -4.364 -3.120 7.605 1.00 0.00 C ATOM 1512 C VAL A 100 -5.564 -3.784 8.280 1.00 0.00 C ATOM 1513 O VAL A 100 -6.567 -4.006 7.604 1.00 0.00 O ATOM 1514 CB VAL A 100 -3.113 -4.019 7.480 1.00 0.00 C ATOM 1515 CG1 VAL A 100 -3.393 -5.425 6.941 1.00 0.00 C ATOM 1516 CG2 VAL A 100 -2.104 -3.369 6.522 1.00 0.00 C ATOM 0 H VAL A 100 -3.037 -1.895 8.623 1.00 0.00 H new ATOM 0 HA VAL A 100 -4.676 -2.901 6.584 1.00 0.00 H new ATOM 0 HB VAL A 100 -2.732 -4.118 8.497 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -2.460 -5.986 6.886 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -4.087 -5.938 7.607 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -3.832 -5.352 5.946 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -1.223 -4.005 6.436 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -2.561 -3.247 5.540 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -1.811 -2.393 6.910 1.00 0.00 H new ATOM 1526 N ASN A 101 -5.506 -4.044 9.589 1.00 0.00 N ATOM 1527 CA ASN A 101 -6.610 -4.649 10.333 1.00 0.00 C ATOM 1528 C ASN A 101 -7.911 -3.853 10.158 1.00 0.00 C ATOM 1529 O ASN A 101 -8.945 -4.459 9.895 1.00 0.00 O ATOM 1530 CB ASN A 101 -6.203 -4.765 11.808 1.00 0.00 C ATOM 1531 CG ASN A 101 -7.359 -5.113 12.729 1.00 0.00 C ATOM 1532 OD1 ASN A 101 -7.865 -4.262 13.446 1.00 0.00 O ATOM 1533 ND2 ASN A 101 -7.710 -6.380 12.833 1.00 0.00 N ATOM 0 H ASN A 101 -4.688 -3.839 10.163 1.00 0.00 H new ATOM 0 HA ASN A 101 -6.811 -5.645 9.939 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -5.430 -5.527 11.905 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -5.763 -3.821 12.131 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -8.412 -6.660 13.518 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -7.280 -7.080 12.228 1.00 0.00 H new ATOM 1540 N GLN A 102 -7.865 -2.518 10.211 1.00 0.00 N ATOM 1541 CA GLN A 102 -9.052 -1.673 10.064 1.00 0.00 C ATOM 1542 C GLN A 102 -9.732 -1.857 8.701 1.00 0.00 C ATOM 1543 O GLN A 102 -10.961 -1.945 8.589 1.00 0.00 O ATOM 1544 CB GLN A 102 -8.691 -0.194 10.284 1.00 0.00 C ATOM 1545 CG GLN A 102 -8.017 0.088 11.637 1.00 0.00 C ATOM 1546 CD GLN A 102 -8.485 1.396 12.258 1.00 0.00 C ATOM 1547 OE1 GLN A 102 -8.452 2.447 11.614 1.00 0.00 O ATOM 1548 NE2 GLN A 102 -8.897 1.386 13.511 1.00 0.00 N ATOM 0 H GLN A 102 -7.003 -1.993 10.357 1.00 0.00 H new ATOM 0 HA GLN A 102 -9.764 -1.986 10.827 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -8.026 0.131 9.483 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -9.598 0.406 10.209 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -8.228 -0.732 12.323 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -6.936 0.120 11.501 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -8.920 0.510 14.033 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -9.193 2.254 13.958 1.00 0.00 H new ATOM 1557 N TYR A 103 -8.935 -1.890 7.634 1.00 0.00 N ATOM 1558 CA TYR A 103 -9.397 -2.206 6.290 1.00 0.00 C ATOM 1559 C TYR A 103 -9.934 -3.621 6.157 1.00 0.00 C ATOM 1560 O TYR A 103 -10.981 -3.797 5.535 1.00 0.00 O ATOM 1561 CB TYR A 103 -8.256 -1.987 5.317 1.00 0.00 C ATOM 1562 CG TYR A 103 -8.437 -2.606 3.955 1.00 0.00 C ATOM 1563 CD1 TYR A 103 -9.346 -2.034 3.054 1.00 0.00 C ATOM 1564 CD2 TYR A 103 -7.751 -3.787 3.621 1.00 0.00 C ATOM 1565 CE1 TYR A 103 -9.603 -2.667 1.828 1.00 0.00 C ATOM 1566 CE2 TYR A 103 -8.028 -4.442 2.414 1.00 0.00 C ATOM 1567 CZ TYR A 103 -8.971 -3.892 1.520 1.00 0.00 C ATOM 1568 OH TYR A 103 -9.297 -4.552 0.377 1.00 0.00 O ATOM 0 H TYR A 103 -7.935 -1.694 7.683 1.00 0.00 H new ATOM 0 HA TYR A 103 -10.232 -1.542 6.065 1.00 0.00 H new ATOM 0 HB2 TYR A 103 -8.109 -0.914 5.193 1.00 0.00 H new ATOM 0 HB3 TYR A 103 -7.343 -2.385 5.759 1.00 0.00 H new ATOM 0 HD1 TYR A 103 -9.847 -1.110 3.302 1.00 0.00 H new ATOM 0 HD2 TYR A 103 -7.010 -4.190 4.296 1.00 0.00 H new ATOM 0 HE1 TYR A 103 -10.284 -2.218 1.120 1.00 0.00 H new ATOM 0 HE2 TYR A 103 -7.522 -5.364 2.169 1.00 0.00 H new ATOM 0 HH TYR A 103 -8.771 -5.377 0.314 1.00 0.00 H new ATOM 1578 N LEU A 104 -9.252 -4.631 6.697 1.00 0.00 N ATOM 1579 CA LEU A 104 -9.750 -5.999 6.713 1.00 0.00 C ATOM 1580 C LEU A 104 -11.079 -6.075 7.458 1.00 0.00 C ATOM 1581 O LEU A 104 -11.951 -6.857 7.065 1.00 0.00 O ATOM 1582 CB LEU A 104 -8.738 -6.962 7.358 1.00 0.00 C ATOM 1583 CG LEU A 104 -7.726 -7.505 6.344 1.00 0.00 C ATOM 1584 CD1 LEU A 104 -6.565 -6.577 6.047 1.00 0.00 C ATOM 1585 CD2 LEU A 104 -7.110 -8.813 6.823 1.00 0.00 C ATOM 0 H LEU A 104 -8.338 -4.520 7.135 1.00 0.00 H new ATOM 0 HA LEU A 104 -9.899 -6.304 5.677 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -8.207 -6.446 8.157 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -9.273 -7.794 7.816 1.00 0.00 H new ATOM 0 HG LEU A 104 -8.318 -7.630 5.438 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -5.902 -7.045 5.320 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -6.944 -5.639 5.641 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -6.013 -6.379 6.966 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -6.396 -9.172 6.081 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -6.597 -8.648 7.770 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -7.895 -9.556 6.961 1.00 0.00 H new ATOM 1597 N SER A 105 -11.274 -5.230 8.470 1.00 0.00 N ATOM 1598 CA SER A 105 -12.539 -5.119 9.185 1.00 0.00 C ATOM 1599 C SER A 105 -13.592 -4.377 8.360 1.00 0.00 C ATOM 1600 O SER A 105 -14.765 -4.381 8.727 1.00 0.00 O ATOM 1601 CB SER A 105 -12.314 -4.444 10.544 1.00 0.00 C ATOM 1602 OG SER A 105 -11.756 -5.385 11.441 1.00 0.00 O ATOM 0 H SER A 105 -10.551 -4.600 8.817 1.00 0.00 H new ATOM 0 HA SER A 105 -12.925 -6.124 9.355 1.00 0.00 H new ATOM 0 HB2 SER A 105 -11.647 -3.589 10.433 1.00 0.00 H new ATOM 0 HB3 SER A 105 -13.257 -4.064 10.936 1.00 0.00 H new ATOM 0 HG SER A 105 -11.608 -4.959 12.311 1.00 0.00 H new ATOM 1608 N GLY A 106 -13.210 -3.765 7.240 1.00 0.00 N ATOM 1609 CA GLY A 106 -14.094 -3.094 6.306 1.00 0.00 C ATOM 1610 C GLY A 106 -14.395 -1.651 6.699 1.00 0.00 C ATOM 1611 O GLY A 106 -15.192 -1.017 6.006 1.00 0.00 O ATOM 0 H GLY A 106 -12.232 -3.725 6.952 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -13.643 -3.108 5.314 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -15.030 -3.649 6.238 1.00 0.00 H new ATOM 1615 N GLN A 107 -13.793 -1.114 7.769 1.00 0.00 N ATOM 1616 CA GLN A 107 -14.144 0.233 8.226 1.00 0.00 C ATOM 1617 C GLN A 107 -13.612 1.266 7.228 1.00 0.00 C ATOM 1618 O GLN A 107 -14.340 2.153 6.768 1.00 0.00 O ATOM 1619 CB GLN A 107 -13.599 0.515 9.637 1.00 0.00 C ATOM 1620 CG GLN A 107 -14.209 -0.381 10.726 1.00 0.00 C ATOM 1621 CD GLN A 107 -13.947 0.154 12.137 1.00 0.00 C ATOM 1622 OE1 GLN A 107 -12.983 0.874 12.382 1.00 0.00 O ATOM 1623 NE2 GLN A 107 -14.779 -0.189 13.104 1.00 0.00 N ATOM 0 H GLN A 107 -13.076 -1.582 8.323 1.00 0.00 H new ATOM 0 HA GLN A 107 -15.230 0.304 8.280 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -12.517 0.381 9.632 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -13.790 1.558 9.889 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -15.284 -0.463 10.565 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -13.796 -1.386 10.639 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -15.580 -0.787 12.900 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -14.621 0.144 14.055 1.00 0.00 H new ATOM 1632 N LEU A 108 -12.326 1.128 6.904 1.00 0.00 N ATOM 1633 CA LEU A 108 -11.570 1.997 6.010 1.00 0.00 C ATOM 1634 C LEU A 108 -12.134 1.929 4.587 1.00 0.00 C ATOM 1635 O LEU A 108 -12.581 0.864 4.148 1.00 0.00 O ATOM 1636 CB LEU A 108 -10.092 1.573 6.068 1.00 0.00 C ATOM 1637 CG LEU A 108 -9.175 2.642 6.682 1.00 0.00 C ATOM 1638 CD1 LEU A 108 -9.575 3.093 8.089 1.00 0.00 C ATOM 1639 CD2 LEU A 108 -7.754 2.106 6.752 1.00 0.00 C ATOM 0 H LEU A 108 -11.758 0.368 7.278 1.00 0.00 H new ATOM 0 HA LEU A 108 -11.654 3.037 6.326 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -10.007 0.655 6.649 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -9.747 1.345 5.060 1.00 0.00 H new ATOM 0 HG LEU A 108 -9.263 3.511 6.030 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -8.873 3.848 8.443 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -10.579 3.515 8.064 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -9.558 2.237 8.764 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -7.101 2.862 7.187 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -7.734 1.209 7.371 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -7.407 1.862 5.748 1.00 0.00 H new ATOM 1651 N LYS A 109 -12.104 3.053 3.856 1.00 0.00 N ATOM 1652 CA LYS A 109 -12.800 3.182 2.570 1.00 0.00 C ATOM 1653 C LYS A 109 -12.080 4.064 1.558 1.00 0.00 C ATOM 1654 O LYS A 109 -11.286 4.940 1.905 1.00 0.00 O ATOM 1655 CB LYS A 109 -14.236 3.691 2.785 1.00 0.00 C ATOM 1656 CG LYS A 109 -14.375 5.156 3.249 1.00 0.00 C ATOM 1657 CD LYS A 109 -14.205 5.348 4.761 1.00 0.00 C ATOM 1658 CE LYS A 109 -14.652 6.770 5.110 1.00 0.00 C ATOM 1659 NZ LYS A 109 -14.788 7.002 6.564 1.00 0.00 N ATOM 0 H LYS A 109 -11.599 3.893 4.139 1.00 0.00 H new ATOM 0 HA LYS A 109 -12.816 2.180 2.142 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -14.785 3.574 1.851 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -14.720 3.050 3.522 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -13.633 5.763 2.730 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -15.356 5.529 2.953 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -14.800 4.616 5.307 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -13.166 5.193 5.050 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -13.932 7.480 4.702 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -15.608 6.972 4.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -15.093 7.982 6.732 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -15.495 6.347 6.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -13.872 6.840 7.029 1.00 0.00 H new